chempirical

6-Methoxynicotinic acid

C7H7NO3CAS 66572-55-2153.14 g/mol

Open in Covalent MOL file
OOOHN
Carboxylic acidEther

Properties

Molecular formula
C7H7NO3
Molar mass
153.14 g/mol
Exact mass
153.0426 Da
Melting point
171.5–172.5 °C
logP
0.79Crippen estimate
Polar surface area
59.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Identifiers

CAS number
66572-55-2
SMILES
COc1ccc(C(=O)O)cn1
InChIKey
NVDJVEQITUWZDT-UHFFFAOYSA-N
InChI
InChI=1S/C7H7NO3/c1-11-6-3-2-5(4-8-6)7(9)10/h2-4H,1H3,(H,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 3-Pyridinecarboxylic acid, 6-methoxy-
  • 6-Methoxy-3-pyridinecarboxylic acid
  • 3-Carboxy-6-methoxypyridine
  • 6-Methoxypyridine-3-carboxylic acid
  • 2-Methoxy-5-pyridinecarboxylic acid

Work with 6-Methoxynicotinic 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

Methyl 6-methoxynicotinate26218-80-461 % similar 5-Methoxy-2-pyrazinecarboxylic acid40155-42-858 % similar [2,2′-Bipyridine]-5,5′-dicarboxylic acid1802-30-858 % similar P-Anisic acid100-09-456 % similar 2,5-Pyridinedicarboxylic acid100-26-556 % similar 6-Hydrazinonicotinic acid133081-24-054 % similar 6,6′-Dithiodinicotinic acid15658-35-253 % similar 6-Chloronicotinic acid5326-23-853 % 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 2-Methoxy-4-pyridinecarboxylic acid105596-63-2 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

Elsewhere

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