2-fluoro-4-methoxypyridine-3-carboxylic acid

2-fluoro-4-methoxypyridine-3-carboxylic acid

CAS: 1190315-81-1

Formula: C7H6FNO3

SMILES: COC1=CC=NC(F)=C1C(O)=O

IUPAC: 2-fluoro-4-methoxypyridine-3-carboxylic acid

InChI: InChI=1S/C7H6FNO3/c1-12-4-2-3-9-6(8)5(4)7(10)11/h2-3H,1H3,(H,10,11)

Composition: C (49.13%), H (3.53%), F (11.10%), N (8.19%), O (28.05%)

Molar Mass: 171.127

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	171.03317122
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	WHEHLONNPASLOU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.85
Topological Polar Surface Area	59.42
Polarizability	14.17
Ring Count	1
Rotatable Bond Count	2

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