2-Methoxy-4-pyridinecarboxylic acid

C7H7NO3CAS 105596-63-2153.14 g/mol

Open in Covalent MOL file
ONOOH
Carboxylic acidEther

Properties

Molecular formula
C7H7NO3
Molar mass
153.14 g/mol
Exact mass
153.0426 Da
logP
0.79Crippen estimate
Polar surface area
59.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number
105596-63-2
SMILES
COC1=NC=CC(=C1)C(=O)O
InChIKey
DPNDWFVORIGXQO-UHFFFAOYSA-N
InChI
InChI=1S/C7H7NO3/c1-11-6-4-5(7(9)10)2-3-8-6/h2-4H,1H3,(H,9,10)

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Names and synonyms

1 names
  • 2-Methoxyisonicotinic acid

Work with 2-Methoxy-4-pyridinecarboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Methoxynicotinic acid66572-55-259 % similar 2,2'-Bipyridine-4,4'-dicarboxylic acid6813-38-359 % similar 2-Methylpyridine-4-carboxylic acid4021-11-858 % similar Lutidinic acid499-80-957 % similar 2-Fluoroisonicotinic acid402-65-356 % similar 2-Chloro-6-methoxypyridine-4-carboxylic acid15855-06-855 % similar 2-Aminopyridine-4-carboxylic acid13362-28-254 % similar 2-Iodo-isonicotinic acid58481-10-054 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Nitroanisole100-17-4 Methyl 2-oxo-1,2-dihydropyridine-3-carboxylate10128-91-3 4-Methyl-2-nitrophenol119-33-5 2-Methyl-6-nitrophenol13073-29-5 3-Amino-4-hydroxybenzoic acid1571-72-8 2-Methoxynicotinic acid16498-81-0 4-Methyl-3-nitrophenol2042-14-0 4-Amino-3-hydroxybenzoic acid2374-03-0

Elsewhere

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