Hydrocinnamamide, N-benzyl-m-chloro-
Basic information
- CAS
40478-36-2- Standard SMILES
O=C(CCc1cccc(Cl)c1)NCc1ccccc1- InChIKey
VPKDKROSSIUKNR-UHFFFAOYSA-N- Molecular formula
- C16H16ClNO
- Average molar mass
- 273.75 g/mol
- Monoisotopic mass
- 273.0920418
Names & identifiers
- Preferred name
- Hydrocinnamamide, N-benzyl-m-chloro-
- IUPAC
- N-benzyl-3-(3-chlorophenyl)propanamide
Names & synonyms
Hydrocinnamamide, N-benzyl-m-chloro-BRN 2986500N-Benzyl-m-chlorohydrocinnamamideBenzenepropanamide, 3-chloro-N-(phenylmethyl)-40478-36-2N-Benzyl-beta-3-chlorphenylpropionamid [German]N-Benzyl-beta-3-chlorphenylpropionamidDTXSID70193493RefChem:348289DTXCID80115984N-benzyl-3-(3-chlorophenyl)propanamideAKOS003072502
Database identifiers
- CAS
40478-36-2- PubChem CID
- 64878
- DTXSID
DTXSID70193493
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 276
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Compound notes
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