2-chloro-5,8-dimethoxy-4-methylquinoline

2-chloro-5,8-dimethoxy-4-methylquinoline

CAS: 58868-27-2

Formula: C12H12ClNO2

SMILES: COC1=C2N=C(Cl)C=C(C)C2=C(OC)C=C1

IUPAC: 2-chloro-5,8-dimethoxy-4-methylquinoline

InChI: InChI=1S/C12H12ClNO2/c1-7-6-10(13)14-12-9(16-3)5-4-8(15-2)11(7)12/h4-6H,1-3H3

Composition: C (60.64%), H (5.09%), Cl (14.91%), N (5.89%), O (13.46%)

Molar Mass: 237.68

Atom Count: 28

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	237.0556563
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	SVTDGXZOUFALGO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.81
Topological Polar Surface Area	31.35
Polarizability	25.67
Ring Count	2
Rotatable Bond Count	2

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