Basic information
- CAS
53760-52-4- Standard SMILES
O=C(c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1- InChIKey
WJTLJFMQFABDJA-UHFFFAOYSA-N- Molecular formula
- C19H20ClNO
- Average molar mass
- 313.8 g/mol
- Monoisotopic mass
- 313.123342
Names & identifiers
- Preferred name
- (4-Benzyl-piperidin-1-yl)-(4-chloro-phenyl)-methanone
- IUPAC
- (4-benzylpiperidin-1-yl)-(4-chlorophenyl)methanone
Names & synonyms
(4-Benzyl-piperidin-1-yl)-(4-chloro-phenyl)-methanone53760-52-4(4-benzylpiperidin-1-yl)(4-chlorophenyl)methanone4-BENZYL-1-(4-CHLOROBENZOYL)PIPERIDINE260428-70-4(4-benzylpiperidin-1-yl)-(4-chlorophenyl)methanoneCBMicro_000124Oprea1_138114Oprea1_870982SCHEMBL17730097DTXSID90354701WJTLJFMQFABDJA-UHFFFAOYSA-N
Show more names
SMSF0005596STK010811AKOS000673214CB01297EBC-5271334-chlorophenyl 4-benzylpiperidyl ketoneBIM-0000103.P001ST50003020
Database identifiers
- CAS
53760-52-4- PubChem CID
- 779358
- DTXSID
DTXSID90354701
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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