1,2-Bis((chlorocarbonyl)oxy)ethane
Basic information
- CAS
124-05-0- Standard SMILES
O=C(Cl)OCCOC(=O)Cl- InChIKey
FMACOGSACRRIMK-UHFFFAOYSA-N- Molecular formula
- C4H4Cl2O4
- Average molar mass
- 186.97 g/mol
- Monoisotopic mass
- 185.948664
Names & identifiers
- Preferred name
- 1,2-Bis((chlorocarbonyl)oxy)ethane
- IUPAC
- 2-carbonochloridoyloxyethyl carbonochloridate
- English name
- Ethylenebis(chloroformate) puriss 98
- Molecular formula
- C4H4Cl2O4
- Molecular weight
- 186.98
Names & synonyms
1,2-Bis((chlorocarbonyl)oxy)ethaneEthylene bis(chloroformate)Ethylene chloroformateDTXSID2051631Ethylene glycol, bischloroformateEthylene glycol di(chloroformate)Carbonochloride acid, 1,2-ethanediyl esterEINECS 204-674-9BRN 17070463Y32KW65WTAI3-26268Carbonochloridic acid, C,C'-1,2-ethanediyl ester
Show more names
ethylenechloroformatechloro-formicaciethyleneesterethyleneglycoldi(chloroformate)Bis(chloroformic acid)ethylene esterEthylenebis(chloroformate) puriss 98carbonochlorideacid,1,2-ethanediylesterETHYLENEBIS(CHLOROFORMATE), PURISS, 98%carbonochloridicacid,1,2-ethanediylester
DTXCID30301834-03-00-00029 (Beilstein Handbook Reference)C,C'-1,2-ETHANEDIYL DICARBONOCHLORIDATERefChem:196696124-05-0Ethylenebis(chloroformate)2-carbonochloridoyloxyethyl carbonochloridateEthane-1,2-diyl dichlorocarbonate
Database identifiers
- CAS
124-05-0- PubChem CID
- 31282
- DTXSID
DTXSID2051631- ChEMBL
CHEMBL3559948- UNII
- 3Y32KW65WT
- EC Number
- 204-674-9
- Nikkaji
- J49.559J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 119
Physicochemical properties
- Boiling point
- 53 · 53-55 °C/0.3 mmHg (lit.) 53-55 °C/0.3 mmHg
- Density
- 1.436 g/mL · 1.436 g/mL at 25 °C (lit.) 1.4364 g/mL at 25 °C
- refractive index
- 20 · n20/D 1.436(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- 2 · 2-8°C
- InChI
- 1S/C4H4Cl2O4/c5-3(7)9-1-2-10-4(6)8/h1-2H2
- InChIKey
- FMACOGSACRRIMK-UHFFFAOYSA-N
- SMILES
- ClC(=O)OCCOC(Cl)=O
- FDA UNII
- 3 Y32KW65WT · 3Y32KW65WT
- EPA Substance Registry System
- 1 · Carbonochloridic acid, 1,2-ethanediyl ester (124-05-0)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H314
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationChemical: Carbonochloridic acid, 1,2-ethanediyl ester
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- LQ6000000
- ridadr
- UN 3265 8/PG 3
- risk_code
- 22-34
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- Storage Class
- 8A - Combustible corrosive hazardous materials
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCarbonochloridic acid, C,C'-1,2-ethanediyl ester: ACTIVE
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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