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1-(4-chloro-2-methoxyphenyl)methanamine hydrochloride

1-(4-chloro-2-methoxyphenyl)methanamine hydrochloride

CAS: 896127-80-3

Formula: C8H11Cl2NO

SMILES: Cl.COC1=C(CN)C=CC(Cl)=C1

IUPAC: 1-(4-chloro-2-methoxyphenyl)methanamine hydrochloride

InChI: InChI=1S/C8H10ClNO.ClH/c1-11-8-4-7(9)3-2-6(8)5-10;/h2-4H,5,10H2,1H3;1H

Composition: C (46.18%), H (5.33%), Cl (34.07%), N (6.73%), O (7.69%)

Molar Mass: 208.08

Atom Count: 23

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 207.0217694
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey FBBOXHPCLAYPJE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.8
Topological Polar Surface Area 35.25
Polarizability 18.08
Ring Count 1
Rotatable Bond Count 2

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