4-Phenylpiperidinium chloride

HCID 82509

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Basic information

CAS: 10272-49-8
Standard SMILES: Cl.c1ccc(C2CCNCC2)cc1
InChIKey: UPZJLQCUYUTZIE-UHFFFAOYSA-N
Molecular formula: C11H16ClN
Average molar mass: 197.7 g/mol
Monoisotopic mass: 197.09712719

Names & identifiers

Preferred name: 4-Phenylpiperidinium chloride
IUPAC: 4-phenylpiperidine;hydrochloride
English name: 4-Phenylpiperidine hydrochloride
Molecular formula: C11H16ClN
Molecular weight: 197.7

Names & synonyms

4-phenylpiperidine hydrochloride10272-49-84-Phenylpiperidinium chlorideEINECS 233-617-0DTXSID20145467RefChem:526448DTXCID7067958233-617-04-Phenyl-piperidine hydrochlorideMFCD016325274-PHENYL-PIPERIDINE HCL4-phenylpiperidine;hydrochloride

Show more names

4-Phenylpiperdine hydrochloridePiperidine, 4-phenyl-,hydrochloride (1:1)1,2,3,6-Tetrahydro-4-phenylpiperidine hydrochloride

Piperidine, 4-phenyl-, hydrochloride (1:1)4-phenylpiperidinehydrochlorideCHEMBL20115464-Phenyl piperidine hydrochloride4-phenylpiperdine hclorb3029600SCHEMBL14816334-phenyl-piperidin hydrochloride

Database identifiers

CAS: 10272-49-8
PubChem CID: 82509
DTXSID: DTXSID20145467
ChEMBL: CHEMBL2011546
EC Number: 233-617-0

Properties

Computed structural properties

Topological polar surface area: 12 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 121

Physicochemical properties

Melting point: 164 · 164-165℃
storage temp.: Inert atmosphere,Room Temperature
Appearance: White to off-white Solid
InChI: InChI=1S/C11H15N.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h1-5,11-12H,6-9H2;1H
InChIKey: UPZJLQCUYUTZIE-UHFFFAOYSA-N
SMILES: C1(C=CC=CC=1)C1CCNCC1.Cl
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.