Grundinformationen
- Standard-SMILES
O=c1occo1- InChIKey
VAYTZRYEBVHVLE-UHFFFAOYSA-N- Summenformel
- C3H2O3
- Durchschnittliche Molmasse
- 86,05 g/mol
- Monoisotopische Masse
- 86,00039392
Namen und Bezeichner
- Bevorzugter Name
- Vinylene carbonate
- IUPAC
- 1,3-dioxol-2-one
- Lokaler Name
- Vinylencarbonat
- Englischer Name
- Vinylene carbonate
- Summenformel
- C3H2O3
- Molmasse
- 86.05
Namen und Synonyme
VINYLENE CARBONATE1,3-Dioxol-2-one872-36-61X0ZZF9WFVNSC-20980NSC-47201DTXSID1074888LBG-84922RefChem:901949DTXCID8048573212-825-5Vinyl carbonate
Weitere Namen anzeigen
VCVinylene carboteThe ethylene carbonateVINYLENE CARBONATE (VC)1-methyl-2,3-dihydro-1H-phosphole 1-oxideVinylene carbonate, 99%, water ≤50 ppm, stabilized with 90 ppm BHT1,3-Dioxo-2-oneWITH HYDROQUINONE
2H-1,3-dioxol-2-oneCarbonic acid, cyclic vinylene esterMFCD00005380C3H2O3Vinylene carbonate (stabilized with BHT)WLN: T5OVOJ1,3-Dioxol-2-one,VC25747-73-3
Datenbank-Bezeichner
- CAS
872-36-6- PubChem CID
- 13385
- DTXSID
DTXSID1074888- UNII
- 1X0ZZF9WFV
- EC Number
- 212-825-5
- Nikkaji
- J55.532K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,3
- Polarare Oberfläche (TPSA)
- 35,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 6
- Formalladung
- 0
- Komplexität
- 84,2
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesSchoenflies notation
Physical DescriptionLiquid; Dry Powder
Physikochemische Eigenschaften
- Schmelzpunkt
- 19 · 19-22 °C(lit.)
- Siedepunkt
- 162 °C · 162 °C(lit.)
- Dichte
- 1.36 g/mL · 1.360 g/mL at 20 °C
- Dampfdruck
- 3.35 hPa · 3.35hPa at 25℃
- Brechungsindex
- 20 · n20/D 1.421(lit.)
- Flammpunkt
- 163 °F · 163 °F
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- 11.5 g/100 · 11.5 g/100 mL
- Aggregatzustand
- Liquid
- Wichte
- 1.355 · 1.355
- Farbe
- Colorless to pale yellow
- Wasserlöslichkeit
- 11.5 g/100 · 11.5 g/100 mL
- BRN
- 105683 · 105683
- InChI
- 1S/C3H2O3/c4-3-5-1-2-6-3/h1-2H
- InChIKey
- VAYTZRYEBVHVLE-UHFFFAOYSA-N
- SMILES
- O=C1OC=CO1
- LogP
- -0.36 at · -0.36 at 20℃
- CAS Datenbank
- 872 · 872-36-6(CAS DataBase Reference)
- NIST chemische Informationen
- 1 · 1,3-Dioxol-2-one(872-36-6)
- EPA chemische Informationen
- 1 · 1,3-Dioxol-2-one (872-36-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 0.4% (1 of 263) of reports.
Danger
H302 (99.2%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P261, P262, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P354+P338, P316, P317, P318, P319, P321, P330, P332+P317, P333+P317, P361+P364, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 263 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
1,3-Dioxol-2-one is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3-Dioxol-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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 19-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/10740
Peroxide Forming Chemical
Vinylene carbonate
D: Other compounds that may form peroxides
Kelly
An account of a container bursting in storage. Could be due to carbon dioxide evolution, but other factors cannot be ruled out. See Bretherick's.
Hazard Classes and CategoriesAcute Tox. 4 (99.2%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN2810 - class 6.1 - PG 3 - EHS - Toxic, liquids, organic, n.o.s., HI: all
- hs_code
- 29209090
- RTECS-Nr.
- FG3325000
- risk_code
- 43-36-51/53-48/22-41-38-24-22
- hazard_code
- Xi,N,T
- safety_code
- 37/39-26-24-61-45-36/37/39
- hazard_class
- 6.1
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 4 OralAquatic Chronic 2Eye Dam. 1Skin Irrit. 2Skin Sens. 1STOT RE 2 Oral
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 1,000,000 - <2,500,000 lb
Consumer UsesSolvent
Industry UsesSolvent
General Manufacturing Information
Transportation Equipment Manufacturing
1,3-Dioxol-2-one: ACTIVE
Anwendungen
VerwendenVinylene carbonate is used as an additive to electrolyte solutions for anode side Lithiumion batteries. It also acts as a sealant to seal at least a portion of the silicon-polyvinyl acid interface. It is further used for great improvement of high temperature performance of the battery.
Darstellung
synthetischeVinylene carbonate is produced by the known method by eliminating hydrogen chloride from chloroethylene glycol carbonate by means of tertiary amines, in particular triethylamine. Chloroethylene glycol carbonate is obtained by free radical chlorination of ethylene glycol carbonate by means of chlorine or sulphuryl chloride. This synthesis was published for the first time in 1953 by Newman and Addor (JACS, 1953, page 1263; JACS 1955, page 3789).
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