Basic information
- CAS
107-69-7- Standard SMILES
NC(=O)OCC(Cl)(Cl)Cl- InChIKey
QPLJYAKLSCXZSF-UHFFFAOYSA-N- Molecular formula
- C3H4Cl3NO2
- Average molar mass
- 192.42 g/mol
- Monoisotopic mass
- 190.930761
Names & identifiers
- Preferred name
- Trichlorourethan
- IUPAC
- 2,2,2-trichloroethyl carbamate
- English name
- 2,2,2-trichloroethyl carbamate
- Molecular formula
- C3H4Cl3NO2
- Molecular weight
- 192.42836
Names & synonyms
Trichlorourethan107-69-7VoluntalTrichloroethyl carbamateTrichlorourethaneEINECS 203-511-9UNII-32RC648BOPBRN 1762058Ethanol, 2,2,2-trichloro-, carbamate32RC648BOPTRICHLOROURETHAN [MI]DTXSID20147860
Show more names
Carbamic acid 2,2,2-trichloroethylCarbamic acid 2,2,2-trichloroethyl ester
3-03-00-00046 (Beilstein Handbook Reference)CARBAMIC ACID, 2,2,2-TRICHLOROETHYL ESTERETHANOL, 2,2,2-TRICHLORO-, 1-CARBAMATERefChem:191023DTXCID1070351Ethanol, 2,2,2-trichloro-, carbamate (9CI)203-511-92,2,2-Trichloroethyl carbamate
Database identifiers
- CAS
107-69-7- PubChem CID
- 7883
- DTXSID
DTXSID20147860- UNII
- 32RC648BOP
- EC Number
- 203-511-9
- Nikkaji
- J5.062H
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Melting point
- 64 · 64-65°
- Density
- 1.6344 · 1.6344 (rough estimate)
- refractive index
- 1.63 · 1.6300 (estimate)
- color
- Needles from ligroin
- FDA UNII
- 32 RC648BOP · 32RC648BOP
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Toxicity
- 20 mmol/plate · mmo-sat 20 mmol/plate CNREA8 40,1194,80
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- mmo-sat 20 mmol/plate CNREA8 40,1194,80
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
10 records
Compound notes
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