CAS 14446-73-2 4-Cyclohexylpiperidine (HCID 424240)

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Basic information

CAS: 14446-73-2
Standard SMILES: C1CCC(C2CCNCC2)CC1
InChIKey: HQSCLNJCVFZWCW-UHFFFAOYSA-N
Molecular formula: C11H21N
Average molar mass: 167.29 g/mol
Monoisotopic mass: 167.16739967

Names & identifiers

Preferred name: 4-Cyclohexylpiperidine
IUPAC: 4-cyclohexylpiperidine
English name: 4-cyclohexylpiperidine(SALTDATA: FREE)
Molecular formula: C11H21N
Molecular weight: 167.29

Names & synonyms

4-cyclohexylpiperidine14446-73-2DTXSID00329829RefChem:292287DTXCID40280925Piperidine, 4-cyclohexyl-MFCD073653564-cyclohexylpiperidine(SALTDATA: FREE)4-cyclohexylpiperdine4-Cyclohexyl-piperidine4--cyclohexyl piperidine4-(1-cyclohexyl)piperidine

Show more names

SCHEMBL1461249SCHEMBL2103206SCHEMBL90682704-cyclohexylpiperidine(SALTDATASCHEMBL27840517SCHEMBL27840522SCHEMBL28247554SCHEMBL28891825

Database identifiers

CAS: 14446-73-2
PubChem CID: 424240
DTXSID: DTXSID00329829
Nikkaji: J1.844.582D

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 12 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 121

Physicochemical properties

Melting point: 75 · 75-78 °C
Boiling point: 248.8 · 248.8±8.0 °C(Predicted)
Density: 0.916 · 0.916±0.06 g/cm3(Predicted)
pka: 10.45 · 10.45±0.10(Predicted)
HazardClass: IRRITANT

Safety & regulation

Safety data

hazard_class: IRRITANT

Chemistry & industry

Applications

Uses4-Cyclohexylpiperidine is a reactant in the preparation(N-alkylation) of aminoalkyl naphtholactams and naphthosultams as serotoninergic 5-HT7 receptor antagonists.