Basic information
- Standard SMILES
CCN(CC)C(=O)c1ccc(C(Cl)c2ccccc2)cc1- InChIKey
ZAWUOUAUXZOGPL-UHFFFAOYSA-N- Molecular formula
- C18H20ClNO
- Average molar mass
- 301.8 g/mol
Names & identifiers
- Preferred name
- 4-(N,N-diethylcarbamoyl)benzhydryl chloride
- IUPAC
- 4-[chloro(phenyl)methyl]-N,N-diethylbenzamide
Names & synonyms
SCHEMBL4576597ZAWUOUAUXZOGPL-UHFFFAOYSA-N4-(N,N-diethylcarbamoyl)benzhydryl chloride
Database identifiers
- PubChem CID
- 10733095
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 315
Related reactions
9 records
Compound notes
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