Basic information
- CAS
63884-92-4- Standard SMILES
O=NN(CCCl)C(=O)OCCF- InChIKey
KZPSRWCCBAMYKL-UHFFFAOYSA-N- Molecular formula
- C5H8ClFN2O3
- Average molar mass
- 198.58 g/mol
- Monoisotopic mass
- 198.020748
Names & identifiers
- Preferred name
- Carbamic acid, (2-chloroethyl)nitroso-, 2-fluoroethyl ester
- IUPAC
- 2-fluoroethyl N-(2-chloroethyl)-N-nitrosocarbamate
Names & synonyms
TL 821CARBAMIC ACID, (2-CHLOROETHYL)NITROSO-, 2-FLUOROETHYL ESTER63884-92-4beta-Fluoroethyl N-(beta-chloroethyl)-N-nitrosocarbamateDTXSID70213423RefChem:331933DTXCID701359142-Fluoroethyl (2-chloroethyl)(nitroso)carbamate
Database identifiers
- CAS
63884-92-4- PubChem CID
- 44977
- DTXSID
DTXSID70213423- Nikkaji
- J67.549K
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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