methyl 2,6-dichloro-4-methylpyridine-3-carboxylate

methyl 2,6-dichloro-4-methylpyridine-3-carboxylate

CAS: 1013648-04-8

Formula: C8H7Cl2NO2

SMILES: COC(=O)C1=C(Cl)N=C(Cl)C=C1C

IUPAC: methyl 2,6-dichloro-4-methylpyridine-3-carboxylate

InChI: InChI=1S/C8H7Cl2NO2/c1-4-3-5(9)11-7(10)6(4)8(12)13-2/h3H,1-2H3

Composition: C (43.67%), H (3.21%), Cl (32.22%), N (6.37%), O (14.54%)

Molar Mass: 220.05

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	218.9853839
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	QOTFUYQFPHLJTM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.7
Topological Polar Surface Area	39.19
Polarizability	19.64
Ring Count	1
Rotatable Bond Count	2

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