2,6-diethoxypyridine-4-carboxylic acid

2,6-diethoxypyridine-4-carboxylic acid

CAS: 5397-75-1

Formula: C10H13NO4

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

IUPAC: 2,6-diethoxypyridine-4-carboxylic acid

InChI: InChI=1S/C10H13NO4/c1-3-14-8-5-7(10(12)13)6-9(11-8)15-4-2/h5-6H,3-4H2,1-2H3,(H,12,13)

Composition: C (56.87%), H (6.20%), N (6.63%), O (30.30%)

Molar Mass: 211.217

Atom Count: 28

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	211.084457903
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	OFJQIZRFVUOCFM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.21
Topological Polar Surface Area	68.65
Polarizability	20.56
Ring Count	1
Rotatable Bond Count	5

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