Basic information
- CAS
39082-00-3- Standard SMILES
O=C(CCl)CC(=O)Nc1ccccc1- InChIKey
CJLSDBRIXZFCKV-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO2
- Average molar mass
- 211.64 g/mol
- Monoisotopic mass
- 211.0400063
Names & identifiers
- Preferred name
- Butanamide, 4-chloro-3-oxo-N-phenyl-
- IUPAC
- 4-chloro-3-oxo-N-phenylbutanamide
Names & synonyms
4-Chloro-3-oxo-N-phenylbutanamidegamma-ChloroacetoacetanilideButanamide, 4-chloro-3-oxo-N-phenyl-BRN 2369400ACETOACETANILIDE, 4-CHLORO-EINECS 254-276-4gamma-Chloroaceto acetic acid anilide39082-00-3DTXSID00681553-12-00-00995 (Beilstein Handbook Reference)RefChem:121992DTXCID7039593
Show more names
4-ChloroacetoacetanilideSCHEMBL5364516NS00030506
Database identifiers
- CAS
39082-00-3- PubChem CID
- 38215
- DTXSID
DTXSID0068155- EC Number
- 254-276-4
- Nikkaji
- J28.809H
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Safety & regulation
Hazard information
Regulatory InformationChemical: Butanamide, 4-chloro-3-oxo-N-phenyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Regulatory information
Regulatory InformationChemical: Butanamide, 4-chloro-3-oxo-N-phenyl-
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationButanamide, 4-chloro-3-oxo-N-phenyl-: INACTIVE
Related reactions
3 records
Compound notes
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