2-chloroprop-2-enyl N-(3-chlorophenyl)carbamate
Basic information
- CAS
52010-00-1- Standard SMILES
C=C(Cl)COC(=O)Nc1cccc(Cl)c1- InChIKey
CWONZFWBEOJJET-UHFFFAOYSA-N- Molecular formula
- C10H9Cl2NO2
- Average molar mass
- 246.09 g/mol
- Monoisotopic mass
- 245.0010339
Names & identifiers
- Preferred name
- 2-chloroprop-2-enyl N-(3-chlorophenyl)carbamate
- IUPAC
- 2-chloroprop-2-enyl N-(3-chlorophenyl)carbamate
Names & synonyms
52010-00-12-chloroprop-2-enyl N-(3-chlorophenyl)carbamateNSC408478CHEMBL1979794DTXSID20325065NSC-408478NCI60_0039202-chloroallyl N-(3-chlorophenyl)carbamateDS-007418Carbanilic acid, m-chloro-, 2-chloroallyl ester2-Chloroprop-2-en-1-yl (3-chlorophenyl)carbamateCARBAMIC ACID,(3-CHLOROPHENYL)-, 2-CHLORO-2-PROPENYL ESTER (9CI)
Database identifiers
- CAS
52010-00-1- PubChem CID
- 348953
- DTXSID
DTXSID20325065- ChEMBL
CHEMBL1979794
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 246
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Compound notes
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