Basic information
- CAS
5333-71-1- Standard SMILES
O=C(Nc1cccc(Cl)c1)OC1C=CCC1- InChIKey
ONPWYWAFZMDNTK-UHFFFAOYSA-N- Molecular formula
- C12H12ClNO2
- Average molar mass
- 237.68 g/mol
- Monoisotopic mass
- 237.0556563
Names & identifiers
- Preferred name
- (3-Chlorophenyl)carbamic acid, 2-cycl0penten-1-YL ester
- IUPAC
- cyclopent-2-en-1-yl N-(3-chlorophenyl)carbamate
Names & synonyms
(3-CHLOROPHENYL)CARBAMIC ACID, 2-CYCL0PENTEN-1-YL ESTERNSC24445333-71-1NSC-2444
Database identifiers
- CAS
5333-71-1- PubChem CID
- 220143
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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