methyl 6-chloro-2,4-dimethylpyridine-3-carboxylate

methyl 6-chloro-2,4-dimethylpyridine-3-carboxylate

CAS: 1256789-09-9

Formula: C9H10ClNO2

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

IUPAC: methyl 6-chloro-2,4-dimethylpyridine-3-carboxylate

InChI: InChI=1S/C9H10ClNO2/c1-5-4-7(10)11-6(2)8(5)9(12)13-3/h4H,1-3H3

Composition: C (54.15%), H (5.05%), Cl (17.76%), N (7.02%), O (16.03%)

Molar Mass: 199.63

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	199.0400063
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KEFOCFHFGZFNHO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.43
Topological Polar Surface Area	39.19
Polarizability	19.37
Ring Count	1
Rotatable Bond Count	2

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