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2-(3-chloro-5-methoxyphenyl)piperidine

2-(3-chloro-5-methoxyphenyl)piperidine

CAS: 1273675-26-5

Formula: C12H16ClNO

SMILES: COC1=CC(Cl)=CC(=C1)C1CCCCN1

IUPAC: 2-(3-chloro-5-methoxyphenyl)piperidine

InChI: InChI=1/C12H16ClNO/c1-15-11-7-9(6-10(13)8-11)12-4-2-3-5-14-12/h6-8,12,14H,2-5H2,1H3

Composition: C (63.86%), H (7.15%), Cl (15.71%), N (6.21%), O (7.09%)

Molar Mass: 225.72

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 225.0920418
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey AJKXUQNRRZGJRE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.39
Topological Polar Surface Area 21.26
Polarizability 24.71
Ring Count 2
Rotatable Bond Count 2

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