6-ethoxypyridine-2-carboxylic acid

6-ethoxypyridine-2-carboxylic acid

CAS: 42955-22-6

Formula: C8H9NO3

SMILES: CCOC1=CC=CC(=N1)C(O)=O

IUPAC: 6-ethoxypyridine-2-carboxylic acid

InChI: InChI=1S/C8H9NO3/c1-2-12-7-5-3-4-6(9-7)8(10)11/h3-5H,2H2,1H3,(H,10,11)

Composition: C (57.48%), H (5.43%), N (8.38%), O (28.71%)

Molar Mass: 167.164

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	167.058243154
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	FKYXIGUDCJRHRB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.31
Topological Polar Surface Area	59.42
Polarizability	16.18
Ring Count	1
Rotatable Bond Count	3

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