Basic information
- Standard SMILES
COC(=O)NS(=O)(=O)c1ccccc1Cl- InChIKey
LLVFLMQXGZLNMD-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO4S
- Average molar mass
- 249.67 g/mol
- Monoisotopic mass
- 248.98625642
Names & identifiers
- Preferred name
- Carbamic acid, [(2-chlorophenyl)sulfonyl]-, methyl ester
- IUPAC
- methyl N-(2-chlorophenyl)sulfonylcarbamate
Names & synonyms
137832-63-4Carbamic acid, [(2-chlorophenyl)sulfonyl]-, methyl esterMethyl (2-chlorophenyl)sulfonylcarbamateOprea1_149146SCHEMBL3335057DTXSID40402746LLVFLMQXGZLNMD-UHFFFAOYSA-NAKOS001590042Methyl (2-chlorobenzene-1-sulfonyl)carbamateAG-205/05873062SR-01000078638SR-01000078638-1
Show more names
(2-Chloro-benzenesulfonyl)-carbamic acid methyl ester
Database identifiers
- CAS
137832-63-4- PubChem CID
- 4389137
- DTXSID
DTXSID40402746
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 324
Related reactions
3 records
Linked notes
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