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4-[(3-phenylpropoxy)methyl]piperidine hydrochloride

4-[(3-phenylpropoxy)methyl]piperidine hydrochloride

CAS: 1051919-41-5

Formula: C15H24ClNO

SMILES: Cl.C(COCC1CCNCC1)CC1=CC=CC=C1

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

InChI: InChI=1S/C15H23NO.ClH/c1-2-5-14(6-3-1)7-4-12-17-13-15-8-10-16-11-9-15;/h1-3,5-6,15-16H,4,7-13H2;1H

Composition: C (66.77%), H (8.97%), Cl (13.14%), N (5.19%), O (5.93%)

Molar Mass: 269.81

Atom Count: 42

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 269.1546421
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WGVUBRHIPOBESP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.96
Topological Polar Surface Area 21.26
Polarizability 28.35
Ring Count 2
Rotatable Bond Count 6

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