2-(chloromethyl)-3,4-dimethoxypyridine hydrochloride

2-(chloromethyl)-3,4-dimethoxypyridine hydrochloride

CAS: 72830-09-2

Formula: C8H11Cl2NO2

SMILES: Cl.COC1=C(OC)C(CCl)=NC=C1

IUPAC: 2-(chloromethyl)-3,4-dimethoxypyridine hydrochloride

InChI: InChI=1S/C8H10ClNO2.ClH/c1-11-7-3-4-10-6(5-9)8(7)12-2;/h3-4H,5H2,1-2H3;1H

Composition: C (42.88%), H (4.95%), Cl (31.64%), N (6.25%), O (14.28%)

Molar Mass: 224.08

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	223.016684
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	YYRIKJFWBIEEDH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.17
Topological Polar Surface Area	31.35
Polarizability	18.17
Ring Count	1
Rotatable Bond Count	3

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