에틸렌 카보네이트

Ethylene carbonate

HCID 7303CAS 96-49-1

기본 정보

표준 SMILES
O=C1OCCO1
InChIKey
KMTRUDSVKNLOMY-UHFFFAOYSA-N
분자식
C3H4O3
평균 분자량
88.06 g/mol
단동위원소 질량
88.01604399

개요

Ethylene carbonate is a carbonate ester.

이름 및 식별자

우선 이름
Ethylene carbonate
IUPAC
1,3-dioxolan-2-one
현지명
에틸렌 카보네이트
영어명
Ethylene carbonate
분자식
C3H4O3
분자량
88.06

이름 및 동의어

Ethylene carbonate1,3-DIOXOLAN-2-ONE96-49-1Glycol carbonateEthylene glycol carbonateDioxolone-2Cyclic ethylene carbonateEthylene carbonic acidCarbonic acid, cyclic ethylene esterEthylene glycol, cyclic carbonateEthylenester kyseliny uhliciteDTXSID2026600
이름 더 보기
1,3-다이옥솔레인-2-온에틸렌카보네이트탄산에틸렌글리콜카보네이트디옥솔온-2시클릭에틸렌카보네이트에틸렌탄산에틸1,3-다이옥소란-2-온탄산에틸렌글리콜 카보네이트다이옥소론-2에틸렌 글리콜 카보네이트에틸렌 카보네이트ETHYLENE CARBONATE (EC)Ethylencarbonat1,3-dioxalan-2-oneEthyene CarbonateNSC 11801NSC 16568Texacar EC
RGJ96TB7R7JEFFSOL ECNSC-11801DTXCID806600RefChem:139127202-510-01,3-Dioxacyclopentan-2-one2-Oxo-1,3-dioxolane

데이터베이스 식별자

CAS
96-49-1
PubChem CID
7303
DTXSID
DTXSID2026600
ChEMBL
CHEMBL3181803
ChEBI
CHEBI:178725
UNII
RGJ96TB7R7
EC Number
202-510-0
Nikkaji
J360C

물성

구조 계산 물성

XLogP
0.3
극성 표면적
35.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
0
무거운 원자 수
6

실험 및 물리화학적 성질

SolventsSolvents -> Other Solvents
CosmeticsSolvent
SpringerMaterials PropertiesCoriolis coupling
OdorOdorless
Density · 2건

1.3214 at 39 °C

1.322 @ 40°C

Color/Form · 4건

Monoclinic plates

Colorless solid or liquid

Solid at room temperature.

Colorless liquid or crystalline solid.

물리화학적 성질

녹는점
35 · 35-38 °C(lit.)
끓는 점
243 · 243-244 °C740 mm Hg(lit.)
밀도
1.321 g/mL · 1.321 g/mL at 25 °C(lit.)
증기 밀도
3.04 · 3.04 (vs air)
증기압
0.02 mm · 0.02 mm Hg ( 36.4 °C)
굴절률
1.4199 · 1.4199

화학적 성질

colourless crystals

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 5.7% (31 of 543) of reports.

Warning

H302 (56.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 543 reports by companies from 21 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 5건

Chemical: 1,3-Dioxolan-2-one

Council Directive (EEC) No 109/1989 (Repealed by Reg. EC No 1935/2004 (amended))

1,3-Dioxolan-2-one is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3-Dioxolan-2-one 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: 02-05-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/14909

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

Fire PotentialCombustible when exposed to heat or flame; can react with oxidizing materials.
Hazards SummaryIrritating to eyes and skin; Systemic toxicity following ingestion is probably due to ethylene carbonate being converted into ethylene glycol; [HSDB] A severe eye irritant; [CHEMINFO] An irritant; [MSDSonline] See Ethylene glycol.
Atmospheric Standards · 1건

This action promulgates standards of performance for equipment leaks of Volatile Organic Compounds (VOC) in the Synthetic Organic Chemical Manufacturing Industry (SOCMI). The intended effect of these standards is to require all newly constructed, modified, and reconstructed SOCMI process units to use the best demonstrated system of continuous emission reduction for equipment leaks of VOC, considering costs, non air quality health and environmental impact and energy requirements. Ethylene carbonate is produced, as an intermediate or a final product, by process units covered under this subpart.

Hazard Classes and CategoriesAcute Tox. 4 (56.4%)
Skin, Eye, and Respiratory IrritationsA skin and eye irritant.

안전 및 보호

Disposal Methods · 1건

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Preventive Measures · 1건

SRP: The scientific literature for the use of contact lenses in industry is conflicting. The benefit or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.

Protective Action Criteria (PAC) · 3건

30 [mg/m3]

330 [mg/m3]

2000 [mg/m3]

독성 정보

Environmental Fate · 3건

TERRESTRIALFATE: Based on a classification scheme(1), an estimated Koc value of 9.2(SRC), determined from a structure estimation method(2), indicates that ethylene carbonate is expected to have very high mobility in soil(SRC). Volatilization of ethylene carbonate from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 2.74X10-4 atm-cu m/mole(3,SRC), using a fragment constant estimation method(3), ethylene carbonate is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 9.80X10-3 mm Hg(4). Ethylene carbonate achieved 64.1 percent of its theoretical BOD using an activated sludge inoculum during a 2 week incubation period(5), suggesting biodegradation in soil will be an important environmental fate process(SRC).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 9.2(SRC), determined from a structure estimation method(2), indicates that ethylene carbonate is not expected to adsorb to suspended solids and sediment in water(SRC). Volatilization from water surfaces is expected(3) based upon an estimated Henry's Law constant of 2.74X10-4 atm-cum/mole(4,SRC), developed using a fragment constant estimation method(4). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 3 and 110 hours, respectively(SRC). Ethylene carbonate achieved 64.1 percent of its theoretical BOD using an activated sludge inoculum during a 2 week incubation period(8), suggesting biodegradation in water will be an important process(SRC). Ethylene carbonate is expected to undergo hydrolysis due to the presence of hydrolyzable functional groups(3). According to a classification scheme(5), an estimated BCF of 3.2(SRC), from an estimated log Kow of -0.34(6) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is low.

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), ethylene carbonate, which has a vapor pressure of 9.80X10-3 mm Hg at 25 °C(3), is expected to exist solely as a vapor in the ambient atmosphere. Vapor-phase ethylene carbonate is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 160 hours(SRC), calculated from its rate constant of 2.4X10-12 cu cm/molecule-sec at 25 °C(2) determined using a structure estimation method(2). Ehtylene carbonate may also undergo direct photolysis in the environment since this compound contains a functional group that can absorb light >290 nm(4).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Soil Adsorption/Mobility · 1건

Using a structure estimation method based on molecular connectivity indices(1), the Koc for ethylene carbonate can be estimated to be 9.2(SRC). According to a classification scheme(2), this estimated Koc value suggests that ethylene carbonate is expected to have very high mobility in soil.

TSCA Test Submissions · 1건

1,3-Dioxolan-2-one (Ethylene carbonate, CAS # 96-49-1) was evaluated for teratogenicity in 108 female Sprague-Dawley rats (27/group) orally administered doses of 0 (deionized water control), 750, 1500, and 3000 mg/kg/day on gestation days (GD) 6 through 15. Technical error accounted for solitary maternal lethalities in 1500 and 3000 mg/kg/day groups. Clinical signs of toxicity associated with treatment included post dose salivation (750, 1500, 3000 mg/kg/day), chromodacryorrhea (1500 mg/kg/day), dyspnea (1500, 3000 mg/kg/day), alopecia, decreased body tone, decreased activity and dyspnea (3000 mg/kg/day). Suppressed group mean body weight gain was biologically significant in dams of 3000 mg/kg doses, while food consumption appeared unaffected by treatment. Caesarian section and fetal analyses (at least 24-26 litters, 337-382 fetuses/group) on GD 20 revealed no statistically significant (p</= 0.05) departure from controls in fetal mortality, number of gravid animals per group, total number of implantation sites, viable fetuses, non-viable fetuses, early or late resorptions, corpora lutea, fetal sex distribution, or number and percentage of pre-implantation or post-implantation losses. Group mean fetal body weights were significantly depressed from dams of 1500 and 3000 mg/kg/day dose groups. Fetuses of high-dose (3000 mg/kg/day) dams also exhibited statistically significant increased incidence (10%) of external, soft tissue, and skeletal malformations relative to both current and historical controls. Specifically, increased ossification of the sternebrae 1-4 and non-ossification of the 6th sternebra (1500, 3000 mg/kg/day) and increased incidence of bipartite thoracic vertebra (3000 mg/kg/day) reached statistical significance; fetuses of 3000 mg/kg/day also exhibited an increased, but not statistically significant, incidence of bipartite lumbar vertebra.

Artificial Pollution Sources · 1건

Ethylene carbonate's production and use as a solvent for many polymers and resins, plasticizer, intermediate for pharmaceuticals, rubber chemicals, textile finishing agents, and also in hydroxyethylation reactions(1) may result in its release to the environment through various waste streams(SRC).

Environmental BiodegradationAEROBIC: Ethylene carbonate, present at 100 mg/l, reached 64.1% of its theoretical BOD in 2 weeks using an activated sludge inoculum at 30 mg/l and the Japanese MITI test(1).

규제 정보

Atmospheric Standards · 1건

This action promulgates standards of performance for equipment leaks of Volatile Organic Compounds (VOC) in the Synthetic Organic Chemical Manufacturing Industry (SOCMI). The intended effect of these standards is to require all newly constructed, modified, and reconstructed SOCMI process units to use the best demonstrated system of continuous emission reduction for equipment leaks of VOC, considering costs, non air quality health and environmental impact and energy requirements. Ethylene carbonate is produced, as an intermediate or a final product, by process units covered under this subpart.

안전 데이터

wgk
1
tsca
TSCA listed
rtecs
FF9550000
ridadr
UN 2265 3 / PGIII
독성
LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 2000 mg/kg
HS 번호
29209010

화학 및 산업

약리 정보

Biological Half-Life · 1건

Male Fischer-344-rats were given 200 mg/kg (14)C labeled ethylene-carbonate or 141 mg/kg radiolabeled ethylene-glycol by gavage. Ethylene-glycol was the only ethylene-carbonate metabolite detected. Peak blood ethylene-carbonate and ethylene-glycol concentrations in rats dosed with ethylene-carbonate were 0.028 and 2.3 umol/g, respectively. The respective half lives were 0.25 and 2 hours. The peak blood ethylene-glycol concentration in ethylene-glycol dosed rats was 1.1 umol/g. The half life was 3 hours.

용도 및 제조

Uses · 6건

Used as a solvent for many polymers and resins, a plasticizer, and an intermediate for pharmaceuticals; Also used in the rubber and textile industries; [Hawley] Used as a solvent (surface coatings, plastics, polymers, resins, and lithium-ion battery electrolytes), reactive diluent (urethanes and epoxy resins), dye assistant, plasticizer, water scavenger, foundry sand binder, and chemical intermediate; [CHEMINFO]

Molding and Core Making [Category: Foundry]

Solvent for many polymers and resins, plasticizer, intermediate for pharmaceuticals, rubber chemicals, textile finishing agents, hydroxyethylations reactions.

...ethylene carbonate is a solvent of a number of polymeric materials and plasticizers.

...extensively used as solvents for aromatics, polymers, and saltlike compounds.

Solvent used industrially for /the/ wet spinning /process, which is one of 4 steps in the production of polyacrylonitrile fibers/.

ImpuritiesFractionally distilled ethylene carbonate three times in a column of single-turn glass helices under 3 torr. Analysis by NMR, VPC, and IR showed no detectable impurities.
U.S. Production2023: 25,000,000 - <40,000,000 lb
Consumer UsesSolvent
Industry UsesIon exchange agent
Methods of Manufacturing · 5건

Prepared from ethylene oxide by addition of carbon dioxide with ammonium or alkali metal salts as catalysts.

Interaction of ethylene glycol and phosgene.

Ethylene carbonate is commercially produced by the reaction of ethylene oxide and carbon dioxide at 190-200 °C and 80 atm using Et4NBr as a catalyst.

...by reacting equimolecular amounts of 1,2-ethanediol and phosgene in a closed tube at room temperature.

For more Methods of Manufacturing (Complete) data for 1,3-DIOXOLAN-2-ONE (7 total), please visit the HSDB record page.

응용 분야 · 3건

개요에틸렌 카보네이트 (EC)의 다른 이름 1,3- 디옥 솔란 -2- 온; 에틸렌 글리콜 카보네이트; 무색의 무취 액체이다. 이 제품은 다용도로 사용되는 에틸렌 기반의 솔벤트로서 광범위한 응용 분야와 반응합니다.

용도에틸렌 카르 보 네이트 (EC)는 윤활유 용제, 초 흡수체 제조에서의 가교제, 가스 세정 공정과 유전의 분리, 폴리 카보네이트 디올의 합성 중간체 및 리튬 이온의 중간체로서 사용할 수 있습니다 배터리 및 광 변색 애플리케이션.

용도Ethylene carbonate is an ester of ethylene glycol and carbonic acid. Ethylene carbonate is used as a polar solvent with a molecular dipole moment of 4.9 D, only 0.1 D lower than that of propylene carb onate. It can be used as a high permittivity component of electrolytes in lithium batteries.

공급사50 곳

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]
T&W GROUP021-61551611 13296011611 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]

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