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사이클릭 네오펜탄테트라일비스(옥타데실 포스파이트)

Distearyl pentaerythritol diphosphite

HCID 19645
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기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
3806-34-6
표준 SMILES
CCCCCCCCCCCCCCCCCCOP1OCC2(CO1)COP(OCCCCCCCCCCCCCCCCCC)OC2
InChIKey
PZRWFKGUFWPFID-UHFFFAOYSA-N
분자식
C41H82O6P2
평균 분자량
733 g/mol
단동위원소 질량
732.55866433

이름 및 식별자

우선 이름
Distearyl pentaerythritol diphosphite
IUPAC
3,9-dioctadecoxy-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
현지명
사이클릭 네오펜탄테트라일비스(옥타데실 포스파이트)
영어명
O,O'-Dioctadecylpentaerythritol bis(phosphite)
분자식
C41H82O6P2
분자량
733.03

이름 및 동의어

3806-34-6O,O'-Dioctadecylpentaerythritol bis(phosphite)Distearyl pentaerythritol diphosphiteHSDB 7257UNII-VYL51769RXVYL51769RXEINECS 223-276-6ANTIOXIDANT 118EC 223-276-6DTXSID20275492,4,8,10-Tetraoxa-3,9-diphosphaspiro(5.5)undecane, 3,9-bis(octadecyloxy)-2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)-
이름 더 보기
사이클릭네오펜탄테트라일비스(옥타데실포스파이트)이아인산이스테아릴오에리스리톨이아인산이스테아릴오에리스리톨(DISTEARYLPENTAERYTHRITOLDIPHOSPHITE)Distearyl Pentaerythrityl DiphsophiteAO-118AP-618Weston 618GSPNOS 618JADEWIN AN 618Antioxidant 618JADEADD AN 3019JADEWIN AN 3019antioxidant 3019
pentaerythritol bis(stearyl phosphite)CYCLIC NEOPENTANETETRAYL BIS(OCTADECYL PHOSPHITE)DIOCTADECYL PENTAERYTHRITOL DIPHOSPHITEDIOCTADECYL PENTAERYTHRITYL DIPHOSPHITEDISTEARYL PENTAERYTHRITOL DIPHOSPHITE [HSDB]PHOSPHOROUS ACID, CYCLIC NEOPENTANETETRAYL DIOCTADECYL ESTERRefChem:135130DTXCID507549

데이터베이스 식별자

CAS
3806-34-6
PubChem CID
19645
DTXSID
DTXSID2027549
UNII
VYL51769RX
EC Number
223-276-6
Nikkaji
J217.691B

물성

구조 계산 물성보충 중

XLogP
17.3
극성 표면적
55.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
36
무거운 원자 수
49
형식 전하
0
복잡도
611

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Phosphite Compounds
Polymers · 2건

Plastics -> Antioxidants

Plastics -> Polyolefin-I; Polyolefin-II

LogPlog Kow = 15.05 /Estimated/
Melting Point37-46 °C /Measured/
Vapor Pressure8X10-17 mm Hg at 25 °C /Estimated/
Food Contact Substances · 3건

FCS -> FDA Cumulative Estimated Daily Intake (CEDI)

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications

Henry's Law ConstantHenry's Law constant = 2.6X10-5 atm cu-m/mole at 25 °C /Estimated/
Physical Description · 2건

Liquid; Large Crystals

White waxy flakes; [MSDSonline]

물리화학적 성질

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 38% (101 of 266) of reports.

Danger

H340 (14.3%): May cause genetic defects [Danger Germ cell mutagenicity]

P203, P273, P280, P318, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 266 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: 2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)-

2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)- 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)

REACH registered substance: O,O'-dioctadecylpentaerythritol bis(phosphite) (EC: 223-276-6)

2,4,8,10-Tetraoxa-3,9-diphosphaspiro5.5undecane, 3,9-bis(octadecyloxy)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards Summary10% concentration in cottonseed oil is a mild eye irritant in rabbits; [HSDB]
Special Reports · 1건

The U.S. high production volume (HPV) chemicals are those which are manufactured in or imported into the United States in amounts equal to or greater than one million pounds per year. Robust Summaries include health effects, ecotoxicity data, and environmental fate information for selected chemicals. EPA/Office of Pollution Prevention and Toxics; High Production Volume (HPV) Challenge Program's Robust Summaries and Test Plans. Available from: http://www.epa.gov/chemrtk/viewsrch.htm on 2,4,8,10-tetraoxa-3,9-diphosphaspiro(5.5)undecane,3,9-bis(octadecyloxy)- as of November 3, 2004.

화학 및 산업

용도 및 제조

Uses · 5건

Used as a color and molecular weight stabilizer for polyolefins, polyesters, elastomers, styrenics, engineering thermoplastics, and adhesive formulations; Also used as a commercial antioxidant; [HSDB]

Working with Glues and Adhesives [Category: Other]

O,O'dioctadecylpentaerythritol bis(phosphite) (Weston 618) is used as a color and molecular weight stabilizer for polyolefins, polyesters, elastomers, styrenics, engineering thermoplastics and adhesive formulations.

Commercial antioxidant. /From table/

Plastics -> Typical concentration range in plastic materials -> 0.2%

U.S. Production · 2건

2023: 1,000,000 - <2,500,000 lb

2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)- is listed as a High Production Volume (HPV) chemical (65FR81686). Chemicals listed as HPV were produced in or imported into the U.S. in >1 million pounds in 1990 and/or 1994. The HPV list is based on the 1990 Inventory Update Rule. (IUR) (40 CFR part 710 subpart B; 51FR21438).[EPA/Office of Pollution Prevention and Toxics; High Production Volume (HPV) Challenge Program. 2,4,8,10-Tetraoxa-3,9-diphosphaspiro

Industry UsesStabilizing agent
Formulations/PreparationsTrade name: Weston 618F
Use Classification · 2건

Plastics -> Antioxidants

Plastics -> Polymer Type -> Polyolefin-I; Polyolefin-II

General Manufacturing Information · 2건

Synthetic Rubber Manufacturing

2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)-: ACTIVE

응용 분야

용도Color stabilizer for polymers

일반 설명3,9-Bis(octadecyloxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane is a diphosphaspiro compound which contains two phosphorus atoms and can be used as an antioxidant and as a reducing agent.

관련 반응

1건
반응 기록 만들기
HRID 2403076 반응식
HRID 2403076반응물로uspto-grants-2014_08

화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
더보기
새 노트새 반응견적 요청하기
녹는점
44 · 44-47 °C(lit.)
끓는 점
692.2 · 692.2±55.0 °C(Predicted)
밀도
1.05 · 1.05[at 20℃]
증기압
0 Pa · 0Pa at 25℃
인화점
230 °F · >230 °F
저장 조건
2 · 2-8°C
물리적 상태
solid
수용성
330 ng/L · 330ng/L at 25℃
InChIKey
PZRWFKGUFWPFID-UHFFFAOYSA-N
SMILES
C1C2(COP(OCCCCCCCCCCCCCCCCCC)OC2)COP(OCCCCCCCCCCCCCCCCCC)O1
LogP
16.4 at · 16.4 at 25℃
EPA
2 · 2,4,8,10-Tetraoxa-3,9-diphosphaspiro[5.5]undecane, 3,9-bis(octadecyloxy)- (3806-34-6)
Hazard Classes and CategoriesMuta. 1B (14.3%)

안전 및 보호

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

Non-Human Toxicity Excerpts · 5건

/LABORATORY ANIMALS: Acute Exposure/ /Following application of 10% distearyl pentaerythritol diphosphite in cottonseed oil to the eyes of 6 rabbits/ ...the test material produced a very mild conjunctival effect in two of the animals which cleared by the second day of observation.

/LABORATORY ANIMALS: Acute Exposure/ /Following 2000 mg/kg distearyl pentaerythritol diphosphite applied to the dermis of ten white New Zealand rabbits/ ... the test material induced very slight to moderate erythema on all rabbits and very slight edema on eight rabbits. Desquamation was present on 8 sites by day 7 and one site by day 14. There were no other dermal findings. Three sites had very slight erythema and/or desquamation at study termination (day 14).

/LABORATORY ANIMALS: Subchronic or Prechronic Exposure/ /In a 90 day dietary study, Charles River albino rats were exposed to /Distearyl Pentaerythritol Diphosphite/ at concentrations of 0, 300, 1000, 3000 ppm/ ... Statistical comparisons of final body weights and total weight gains revealed no significant differences between test and control rats. ... The only statistically significant difference reported was the liver/body weight ratio for the 3000 ppm males. The authors of the study concluded that the lack of any consistent dietary or sex-related response indicates that the intergroup differences were not related to treatment. ... Six deaths occurred during the study. All of these deaths resulted from trauma incurred during the collection of blood samples. These deaths occurred in the control as well as the test groups and were not attributed to the ingestion of the test material. ... All of the lesions noted in the microscopic examination of tissues were those of spontaneous disease and are not unusual for the albino rat. The most frequent findings were lesions in the trachea and lungs, indicating chronic murine pneumonia. These occurred in the control as well as the treated rats.

/GENOTOXICITY/ /In a micronucleus assay, male and female ICR mice were exposed to ip doses of /distearyl pentaerythritol diphosphite/ of 0, 500, 1000, 2000 mg/kg bw for 24 or 48 hr./ The test article was judged negative /with/ no statistically significant increase in micronucleated polychromatic erythrocytes above the concurrent vehicle control values and no evidence of dose responses were observed at any sampling time ...

/GENOTOXICITY/ /Distearyl pentaerythritol diphosphite/ was negative in the Ames test using Salmonella strains TA 97, TA 98, TA 100, TA 102 and E. coli WP2/pKM101 at concentrations 0, 0.05, 0.1, 0.2, 9.5 ug/plate with and without metabolic activation. ... Under /study/ conditions, there was neither an increase in number of revertant cells, nor any toxicity.

Antidote and Emergency Treatment · 2건

Advanced treatment: Consider orotracheal or nasotracheal intubation for airway control in the patient who is unconscious, has severe pulmonary edema, or is in respiratory arrest. Positive pressure ventilation techniques with a bag valve mask device may be beneficial. Monitor cardiac rhythm and treat arrhythmias as necessary ... . Start an IV with D5W /SRP: "To keep open", minimal flow rate/. Use lactated Ringer's if signs of hypovolemia are present. Watch for signs of fluid overload. Consider drug therapy for pulmonary edema ... . For hypotension with signs of hypovolemia, administer fluid cautiously. Watch for signs of fluid overload ... . Treat seizures with diazepam (Valium) ... . Use proparacaine hydrochloride to assist eye irrigation ... . /Poison A and B/

Basic treatment: Establish a patent airway. Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if needed. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for pulmonary edema and treat if necessary ... . Monitor for shock and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with normal saline during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 ml/kg up to 200 ml of water for dilution if the patient can swallow, has a strong gag reflex, and does not drool ... . Cover skin burns with dry sterile dressings after decontamination ... . /Poison A and B/

Non-Human Toxicity Values · 2건

LD50 Rabbit dermal >2,000 mg/kg

LD50 Rat oral >1,000 mg/kg

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29092000
기존화학 물질
KE-12414
스토리지 클래스
11 - Combustible Solids
유해 물질 데이터
3806-34-6(Hazardous Substances Data)

상·하류 제품 정보

상류 원료

Phosphite스테아릴 알코올트리페닐 포스파이트삼염화 인펜타에리쓰리톨