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4-[(3,4-dichlorophenyl)methyl]piperidine hydrochloride

4-[(3,4-dichlorophenyl)methyl]piperidine hydrochloride

CAS: 1171138-69-4

Formula: C12H16Cl3N

SMILES: Cl.ClC1=CC=C(CC2CCNCC2)C=C1Cl

IUPAC: 4-[(3,4-dichlorophenyl)methyl]piperidine hydrochloride

InChI: InChI=1S/C12H15Cl2N.ClH/c13-11-2-1-10(8-12(11)14)7-9-3-5-15-6-4-9;/h1-2,8-9,15H,3-7H2;1H

Composition: C (51.36%), H (5.75%), Cl (37.90%), N (4.99%)

Molar Mass: 280.62

Atom Count: 32

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 279.0348326
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey QMXPLRLXVBJVNB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.69
Topological Polar Surface Area 12.03
Polarizability 25.85
Ring Count 2
Rotatable Bond Count 2

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