Basic information
- Standard SMILES
CN(C)C=CC(=O)C(C)(C)c1ccc(Cl)cc1- InChIKey
ZLCDMPOCQDAPIV-UHFFFAOYSA-N- Molecular formula
- C14H18ClNO
- Average molar mass
- 251.75 g/mol
Names & identifiers
- Preferred name
- 4-(4-Chloro-phenyl)-1-dimethylamino-4-methyl-pent-1-en-3-one
- IUPAC
- 4-(4-chlorophenyl)-1-(dimethylamino)-4-methylpent-1-en-3-one
Names & synonyms
SCHEMBL3406356ZLCDMPOCQDAPIV-UHFFFAOYSA-N4-(4-chloro-phenyl)-1-dimethylamino-4-methyl-pent-1-en-3-one
Database identifiers
- PubChem CID
- 68630377
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 289
Related reactions
2 records
Compound notes
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