methyl 2-chloro-6-methoxypyridine-4-carboxylate

methyl 2-chloro-6-methoxypyridine-4-carboxylate

CAS: 42521-10-8

Formula: C8H8ClNO3

SMILES: COC(=O)C1=CC(OC)=NC(Cl)=C1

IUPAC: methyl 2-chloro-6-methoxypyridine-4-carboxylate

InChI: InChI=1S/C8H8ClNO3/c1-12-7-4-5(8(11)13-2)3-6(9)10-7/h3-4H,1-2H3

Composition: C (47.66%), H (4.00%), Cl (17.58%), N (6.95%), O (23.81%)

Molar Mass: 201.61

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	201.0192708
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	DAPAXVAUEVRBGS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.57
Topological Polar Surface Area	48.42
Polarizability	18.42
Ring Count	1
Rotatable Bond Count	3

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