N-vinyl-2-pyrrolidone

HCID 6917CAS 25249-54-1

기본 정보

표준 SMILES
C=CN1CCCC1=O
InChIKey
WHNWPMSKXPGLAX-UHFFFAOYSA-N
분자식
C6H9NO
평균 분자량
111.14 g/mol
단동위원소 질량
111.06841391

개요

N-Vinyl-2-pyrrolidone is a member of pyrrolidin-2-ones.

이름 및 식별자

우선 이름
N-vinyl-2-pyrrolidone
IUPAC
1-ethenylpyrrolidin-2-one
영어명
Crospovidone
분자식
C6H9NO
분자량
111.14176

이름 및 동의어

88-12-0N-VINYL-2-PYRROLIDONE1-Vinyl-2-pyrrolidone1-Vinyl-2-pyrrolidinoneVinylpyrrolidone1-ethenylpyrrolidin-2-one2-Pyrrolidinone, 1-ethenyl-VinylbutyrolactamVinylpyrrolidinone1-Vinylpyrrolidinone1-Ethenyl-2-pyrrolidinoneDTXSID2021440
이름 더 보기
PVPPPOLYVINYLPOLYPYRROLIDONEPLASDONEPolyplasdonePOLYVINYLPYRROLIDONE K 90K-30POLYVIDONEPOLYVIDONUMInsoluble PVPCROSPOVIDONE Type A
DTXCID101440RefChem:1092137201-800-41-vinylpyrrolidin-2-oneN-VinylpyrrolidoneN-Vinyl-2-pyrrolidinoneN-Vinylpyrrolidinone25249-54-1

데이터베이스 식별자

CAS
25249-54-1、88-12-0、9003-39-8、88-12-0; 9003-39-8 (homopolymer)
PubChem CID
6917
DTXSID
DTXSID2021440
ChEMBL
CHEMBL1878943
ChEBI
CHEBI:82551
UNII
76H9G81541
EC Number
201-800-4
Nikkaji
J36.503C

물성

구조 계산 물성

XLogP
0.4
극성 표면적
20.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
1
무거운 원자 수
8

실험 및 물리화학적 성질

DrugsPharmaceuticals
PolymersPlastics & Rubber -> Other Monomers
CosmeticsEmulsion stabilizing; Antistatic; Binding; Film forming; Hair fixing
SpringerMaterials PropertiesChemical shift
LogP · 2건

log Kow = 0.37

0.4

Food AdditivesPROCESSING AID, SURFACE-FINISHING AGENT -> FDA Substance added to food

물리화학적 성질

녹는점
165 °C · ~165 °C (dec.)(lit.)
물리적 상태
가루
색상
흰색에서 황백색까지
수용성
물, 산 및 알칼리성에 불용성.
InChI
InChI=1S/C6H9NO/c1-2-7-5-3-4-6(7)8/h2H,1,3-5H2
InChIKey
WHNWPMSKXPGLAX-UHFFFAOYSA-N

화학적 성질

white to off-white micro-crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P203, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P318, P319, P321, P330, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

This chemical does not meet GHS hazard criteria for 0.1% (1 of 963) of reports.

Danger

H302 (97.2%): Harmful if swallowed [Warning Acute toxicity, oral]

유해성 정보

Regulatory Information · 6건

Chemical: Poly[1-(2-oxo-1-pyrrolidinyl)-1,2-ethanediyl]

Chemical: 2-Pyrrolidinone, 1-ethenyl-

2-Pyrrolidinone, 1-ethenyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Pyrrolidinone, 1-ethenyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 26-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/15035

Polyvinylpyrrolidone: Does not have an individual approval but may be used under an appropriate group standard

Vinylpyrrolidone: Does not have an individual approval but may be used under an appropriate group standard

Other Safety Information · 2건

PEC / SN / Other assessments - N-vinyl-2-pyrrolidone (NVP): Health and Environment

IMAP assessments - Poly[1-(2-oxo-1-pyrrolidinyl)-1,2-ethanediyl]: Human health tier I assessment

Fire HazardsCombustible.
Hazards Summary · 1건

No health effects found in a study of 94 production workers; Animal studies show evidence of liver damage in acute and chronic studies; [ACGIH] An eye and respiratory tract irritant; May cause liver injury; [ICSC] See N-Methyl-2-pyrrolidone.

EC ClassificationSymbol: Xn; R: 20/21/22-37-40-41-48/20; S: 26-36/37/39; Note: D
Special Reports · 2건

European Union/European Chemicals Bureau; Risk Assessment Report: 1-Vinyl-2-pyrrolidone (88-12-0) V39 (2003).

NICNAS; Priority existing chemical assessment report on N-vinyl-2-pyrrolidone (NVP) 11: 134 (2000)

안전 및 보호

Fire FightingUse water spray, powder, foam, carbon dioxide.
First Aid Measures · 4건

Fresh air, rest. Refer for medical attention.

Remove contaminated clothes. Rinse and then wash skin with water and soap.

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

Rinse mouth. Give one or two glasses of water to drink. Refer for medical attention .

Safe StorageSeparated from strong acids. Keep in the dark. Cool. Store only if stabilized.
Exposure Control and Personal Protection0.01 [ppm]
Fire Fighting ProceduresTo fight fire use alcohol foam, carbon dioxide or dry chemical.
Disposal Methods · 1건

SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal, aquatic, and plant life; and conformance with environmental and public health regulations.

독성 정보

Ecotoxicity Values · 5건

LC50 Salmo gairdneri/ renamed Oncorhyncus mykiss (Rainbow trout) 913 mg/L/96 hr; static

LC50 Salmo gairdneri/ renamed Oncorhyncus mykiss (Rainbow trout) 976 mg/L/72 hr; static

EC50 Daphnia magna (immobilization) 130 mg/L/24 hr; 45 mg/L/48 hr /Conditions of bioassay not specified in source examined/

EC50 Scenedesmus subscpicatus (Algae; biomass) 780 mg/L/72 hr /Conditions of bioassay not specified in source examined/

EC50 Scenedesmus subscpicatus (Algae; growth rate) >1000 mg/L/72 hr /Conditions of bioassay not specified in source examined/

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Exposure RoutesThe substance can be absorbed into the body by inhalation, through the skin and by ingestion.
Ecotoxicity Excerpts · 1건

/AQUATIC SPECIES/ Four groups of five animals /(Daphnia magna)/ were used at each dose level of 0.7, 1.6, 3.8, 8.0, 17.9, 40.0, 89.4, 200.0, 447.0 and 1,000 mg/L. Only one control group was used. An EC50 of 45.04 mg/L and a NOEC of 3.6 mg/L after 48 hours were derived from the results. An EC100 of 447 mg/L after 48 hours was also reported.

Signs and Symptoms · 3건

Cough. Sore throat.

Redness. Pain. Severe deep burns.

Abdominal pain. Diarrhoea. Nausea. Vomiting.

Human Toxicity Excerpts · 2건

/HUMAN EXPOSURE STUDIES/ Only one study has been conducted to examine the health of N-VP production workers, a cross-sectional morbidity study. The study included comprehensive medical examinations of the majority of the workforce and no signs of ill health related to N-VP exposure were identified. However, the actual levels of N-VP to which the workforce was exposed are unclear.

/OTHER TOXICITY INFORMATION/ In liver biopsies from people who had received polyvinyl pyrrolidone iv, basophilic globular deposits were observed in Kupffer cells, occasionally accompanied by mild inflammation. Thesaurismosis (a foam-cell storage phenomenon characterized by swollen cells with reticulated nuclei loaded with vacuoles or deposits of polyvinyl pyrrolidone) has been observed after inhalation of hair sprays containing polyvinyl pyrrolidone and may be accompanied by pulmonary fibrosis and pneumonia. /Polyvinyl pyrrolidone/

안전 데이터

wgk
1
rtecs
TR8370000
HS 번호
39059900
safety_code
22-24/25
스토리지 클래스
11 - Combustible Solids

화학 및 산업

약리 정보

Biological Half-Life · 4건

The disposition of N-[14C]-vinyl-2-pyrrolidone has been studied in male Sprague-Dawley rats following a single iv injection. The plasma half-life was 1.9 hr.

...The hydrolysis of /N-vinylpyrrolidone/ (N-VP) at 37 °C and pHs ranging from 1.2-7.2 /was studied/. ...The rate of hydrolysis was inversely related to pH such that at a pH of 1.2 the half-life of N-VP in aqueous solution was only around 1.5 min; at pHs ranging from 2.2-2.5, half-lives of 20-40 min were observed; at a pH of 3.5, the half-life had risen to over 6 hr and at a pH of 7.2, N-VP was stable in aqueous solution for at least 24 hr.

/N-Vinylpyrrolidone/ (N-VP) in aqueous solution was also administered by naso-gastric tube to 3 fasted dogs at successive dose levels of 5, 10 and 20 mg/kg and non-fasted dogs (fasted overnight then allowed a meal 30 min before dosing) at 20 mg/kg. ...Elimination from plasma followed an exponential pattern, with half-lives ranging between 0.3 and 0.6 hr, and was independent of dose.

...Anesthetized rats were given 14C(vinyl)-N-VP in aqueous solution via the jugular vein. ... Elimination from the blood followed a biphasic pattern and half-lives for the slow phase of around 1.5-1.9 hr were calculated. These half-life values are somewhat higher than those calculated in the previous oral and other iv studies.

Metabolism/Metabolites · 2건

...The hydrolysis of /N-vinylpyrrolidone/ (N-VP) at 37 °C and pHs ranging from 1.2-7.2 /was studied/. ...The major hydrolysis products, accounting for around 95% of hydrolysed N-VP, were identified as 2-pyrrolidone and acetaldehyde (in hydrated form) with acetaldehyde-hemihydrate accounting for the remaining 5%.

The ability of N-VP to bind to plasma proteins or microsomal proteins in vitro has been briefly investigated. At most, 12% of N-VP or its metabolites were bound to proteins, lending further weight to the conclusion that N-VP is not metabolized to an alkylating species.

Absorption, Distribution and Excretion · 5건

The disposition of N-[14C]-vinyl-2-pyrrolidone has been studied in male Sprague-Dawley rats following a single iv injection. ...Up to 6 hr after dosing, the highest tissue concentrations of radioactivity were found in the liver and small intestines. By that time, about 19% of the dose had been excreted in bile, yet, by 12 hr, only about 0.4% had been excreted in feces while about 75% had been excreted in urine. Thus, there appeared to be substantial enterohepatic recirculation of biliary metabolites. Very small quantities of the administered material were excreted unchanged. In a single rat, 12% of the urinary radioactivity was present as acetic acid. Other metabolites were not identified.

Following ingestion /1-vinyl-2-pyrrolidinone/ is mainly distributed in the liver and small intestine. It is partially excreted in the urine in an acetate form, but it is mostly (88%) combined with water-soluble acid compounds. Following iv injection, 14C-1-vinyl-2-pyrrolidinone was cleared from the blood with a half-life of about 2 hr. Unchanged /1-vinyl-2-pyrrolidinone/ accounted for <0.6% of the dose administered.

The disposition of N-[14C-vinyl]-2-pyrrolidinone was studied in male Sprague-Dawley rats following a single iv injection. Plasma levels of the intact compound dropped rapidly within the first 6 hours after dosing... . Urinary excretion by 12 hours represented 74.9% of a 5 microCi dose while 18.7% was excreted into the bile by 6 hours. 14C-activity attributed to the intact compound was found to be <0.59% of the dose in the urine and <0.46% in the bile. Tissue distribution studies showed that the liver and small intestines and contents contained the highest accumulation of 14C-activity up to 6 hours after administration of N-[14C-vinyl]-2-pyrrolidinone. Urine analyses performed for metabolite elucidation indicated that 12% of the radioactivity dosed was incorporated into acetate and the major remaining portion in species which appeared to be water soluble acidic compounds.

The toxic effects of vinylpyrrolidone /and/ vinylacetate (VP-VA) were examined in rats. Female Wistar-rats, under ether narcosis, were given endotracheally 0.5 mL of a standard solution of VP-VA (10 g in 15 mL of physiological sodium-chloride solution). Other rats received up to 7 times the 2 mL standard solution daily under the skin of the back; between 1.1 and 45.0 g/kg VP-VA were injected. The animals were sacrificed between 1 and 365 days following the application of the VP-VA solution. Tissues were stained and examined by electron microscopy. One to 2 days after endotracheal injection, the alveoli were closely packed with macrophages. Four to 6 months after the last injection, there was still VP-VA in the lungs with the attendent macrophages. Animals killed 1 yr after the last injection showed no VP-VA in the lungs. After sc injection, most of the VP-VA was stored in the spleen. There were occasional, large macrophages found in the interstitial tissue of the lung. During the 1 yr period of observation, there was no evidence of tumors or systemic disease. ...

For more Absorption, Distribution and Excretion (Complete) data for 2-PYRROLIDINONE,1-ETHENYL- (11 total), please visit the HSDB record page.

용도 및 제조

Uses · 6건

Used as a monomer in the production of polyvinyl pyrrolidone; also used in the production of other polymers and organic chemicals; [ACGIH]

Using Disinfectants or Biocides [Category: Clean]

Used to manufacture water-soluble and insoluble forms of polyvinyl pyrrolidone for pharmaceutical and cosmetic industries and to make copolymers with other monomers intended for use in contact with food. ...Used in cast films adherent to glass, metals, plastics.

Solvent for resins, co-monomer for polymerization, binder in cosmetic and pharmaceutical preparations.

...About 10-15% of the monomer is used in the pharmaceutical industry for the production of PVP-iodine complex used as a disinfectant. It is also used as a reactive solvent of UV-curable resins for the production of printing inks and paints as paper and textile auxiliaries, and as an additive in the cosmetics industry.

... Precursor and intermediate for process auxiliaries and additives. The main areas of use are the production of polyvinylpyrrolidone and copolymers, the preferred comonomers being vinyl acetate and methyl acrylate.

U.S. Production2023: 55,000,000 - <70,000,000 lb
Consumer UsesAdhesion/cohesion promoter
Industry UsesMonomers
Methods of Manufacturing · 1건

Industrially, NVP is produced by reacting 2-pyrrolidone with acetylene in high-pressure autoclaves at 130-160 °C and pressures of up to 2.6 MPa. Vinylation proceeds in the liquid phase and is catalyzed by 2-pyrrolidone-potassium, which is obtained by dissolving 1-5% potassium hydroxide (the water formed is removed by distillation in vacuo) or potassium in 2-pyrrolidone. To avoid the danger of explosions acetylene-nitrogen mixtures are used instead of acetylene. The crude product obtained by continuous or batch production is purified by vacuum distillation.

Formulations/Preparations · 3건

A typical commercial product has the following composition: NVP content, minimum 99 weight percent; 2-pyrrolidone, maximum 0.2 weight percent; water, maximum 0.1 weight percent; color index (freshly filled, APHA), 40 maximum; stabilizers: 10 ppm N,N'-bis(1-methylpropyl)-1,4-benzenediamine or 0.1 weight percent sodium hydroxide.

Polyquaternium-11 is a copolymer of vinylpyrrolidone and dimethylamine ethylmethacrylate, partially quaternized with diethyl sulfate....Industry specifications for Polyquaternium-11 allow residual vinylpyrrolidone to a maximum concentration of 1.0%. ...The principal use of Polyquaternium-11 in cosmetic products is in hair care preparations.

Polyvinylpyrrolidone/Vinyl Acetate Copolymer (PVP/VA Copolymer) is the copolymer of vinyl pyrrolidone (VP) and vinyl acetate (VA) monomers. The copolymers vary in their ratio of VP to VA and range from 70:30 to 30:70 VP to VA.

응용 분야 · 2건

개요PVP-P 쉽게 친수성 이며 페 놀 등으로 같은 물질과 복잡 한 수 있는 희미 한 독특한 냄새와 함께 백색 또는 크림 백색 분말으로 동작 합니다. 그것은 상대적으로 높은 crosslink 밀도와 완전히 용 해 하 고 해체, 해산 및 마약을 방해 할 수 있는 폼 젤 하지 해제지 않습니다. Ph Eur 5.0 및 USP/NF28th로 받아들여졌다.

용도PVP (polyvinylpyrrolidone) is a chemical ingredient that, depending on the formulatory requirement, can act as a binder, viscosity controller, emulsion stabilizer, or film former. Its benefits include water and wear resistance, pigment dispersion, a non-greasy feel, and improved stick integrity. PVP is commonly found in waterproof sunscreens, mascaras, and lipsticks in order to improve their wear.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
武汉问津化学科技有限公司13517196568 · [email protected]
추가 설명 · 2건

순도시험(1) 액성 : 이 품목 1g을 물에 현탁시켜 100mL로 한 수용액의 pH는 5.0~11.0이어야 한다. (2) 물가용액 : 이 품목 약 25.0g을 정밀히 달아 증류플라스크에 넣고 물 225mL를 가하여 환류냉각기를 부착하여 교반기를 이용하여 섞으면서 20시간 가열한다. 냉각 후 이 액을 메스플라스크에 옮겨 물을 가하여 250mL로 하고, 15분간 정치시킨 후 이 상등액을 원심분리 시킨다(12,000rpm, 1시간). 이 상등액을 구멍크기 0.45μm의 멤브레인필터로 여과하여 여액 50mL를 정확히 취하여, 미리 무게를 단 유리제 증발접시에 넣어 증발건고한다. 다시 90℃에서 3시간 동안 건조하고 데시케이터에서 방냉한 후 중량을 정밀히 달았을 때, 그 양은 1.5% 이하이어야 한다. (3) 질소 : 이 품목 100mg을 분해플라스크에 취하여 황산칼륨과 황산동(10 : 1)의 혼합물 1g을 넣고 플라스크에 내벽을 소량의 물로 씻어 내린다. 다시 황산 7mL를 가하여 플라스크를 흔들어 주면서 30% 과산화수소 1mL를 서서히 가하여 내용물이 청색의 투명한 액이 될 때까지 가열하여 분해한다. 분해가 완료되면 식힌 다음 물 20mL를 가한 액을 시험용액으로 하여 질소정량법에 따라 시험할 때, 그 양은 11.0~12.8%이어야 한다. (4) 납 : 이 품목 5.0g을 취하여 원자흡광광도법 또는 유도결합플라즈마발광광도법에 따라 시험할 때, 그 양은 2.0ppm 이하이어야 한다. (5) 아연 : 이 품목 5.0g을 취하여 원자흡광광도법 또는 유도결합플라즈마발광광도법에 따라 시험할 때, 그 양은 25ppm 이하이어야 한다. (6) N-비닐피로리돈 : 이 품목 4g을 정밀히 달아 물 30mL를 가하고 15분간 교반한 다음 원심분리관에 옮기고 물 20mL로 잔류물을 씻어 합한 다음 원심분리 한다. 상등액을 유리여과기(1G4 또는 이와 동등한 것)로 여과하고 잔류물을 물 50mL로 씻어 여액과 합한다. 이 액에 초산나트륨 0.5g을 가하고 요오드의 색이 없어지지 않을 때까지 0.1N 요오드용액을 가한다. 다시 0.1N 요오드용액 3mL를 가하고 10분간 방치한 다음 0.1N 치오황산나트륨용액으로 과잉의 요오드를 적정할 때, 0.1N 요오드용액의 소비량은 0.72mL를 초과하여서는 아니 된다. 따로, 공시험을 실시한다(0.1% 이하).0.1N 요오드용액 1mL = 5.56mg N-비닐피로리돈 (7) 불포화물 : 이 품목 4g을 취하여 물 30mL를 가하고 15분간 교반시킨 다음 250mL 삼각플라스크에 유리여과기를 사용하여 여과하고 잔류물을 물 100mL로 씻어 여액과 세액을 합친다. 이 액에 초산나트륨 0.5g을 가한 후 0.1N 요오드용액으로 색이 더 이상 엷어지지 않을 때까지 적정하고 여기에 3mL를 더 가하여 10분간 방치한 후 과잉의 요오드를 0.1N 치오황산나트륨용액으로 적정한다(지시약 : 전분시액). 따로 같은 방법으로 공시험을 하여 다음 계산식에 따라 그 양을 구할 때, 불포화물은 0.1% 이하이어야 한다. a : 본시험의 0.1N 치오황산나트륨용액의 소비량(mL) b : 공시험의 0.1N 치오황산나트륨용액의 소비량(mL) N : 0.1N 치오황산나트륨용액의 규정도

확인시험이 품목 약 1g을 물 10mL에 넣어 현탁 시킨 후 요오드시액 0.1mL를 넣고 30초 동안 흔들었을 때 탈색이 된다. 다시 여기에 전분시액 1mL를 넣고 흔들면 청색을 나타내지 않는다.

관련 반응

211건

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