4-[(3-fluoro-4-methoxyphenyl)methyl]piperidine hydrochloride

4-[(3-fluoro-4-methoxyphenyl)methyl]piperidine hydrochloride

CAS: 1171578-73-6

Formula: C13H19ClFNO

SMILES: Cl.COC1=CC=C(CC2CCNCC2)C=C1F

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

InChI: InChI=1S/C13H18FNO.ClH/c1-16-13-3-2-11(9-12(13)14)8-10-4-6-15-7-5-10;/h2-3,9-10,15H,4-8H2,1H3;1H

Composition: C (60.11%), H (7.37%), Cl (13.65%), F (7.31%), N (5.39%), O (6.16%)

Molar Mass: 259.75

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	259.1139201
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KVRUPCCEMZAYJN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.76
Topological Polar Surface Area	21.26
Polarizability	24.27
Ring Count	2
Rotatable Bond Count	3

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