6-Chloro-4-methoxy-3-pyridinecarboxylic acid

C₇H₆ClNO₃CAS 716362-10-6187.58 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Ether

Properties

Molecular formula: C₇H₆ClNO₃
Molar mass: 187.58 g/mol
Exact mass: 187.0036 Da
logP: 1.44Crippen estimate
Polar surface area: 59.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Identifiers

CAS number

716362-10-6

SMILES

COc1cc(Cl)ncc1C(=O)O

InChIKey

DFXUFJAAXAJWSA-UHFFFAOYSA-N

InChI

InChI=1S/C7H6ClNO3/c1-12-5-2-6(8)9-3-4(5)7(10)11/h2-3H,1H3,(H,10,11)

Weigh it out

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

Names and synonyms

4 names

3-Pyridinecarboxylic acid, 6-chloro-4-methoxy-
6-Chloro-4-methoxynicotinic acid
6-Chloro-4-methoxypyridine-3-carboxylic acid
2-Chloro-4-methoxy-5-pyridinecarboxylic acid

Work with 6-Chloro-4-methoxy-3-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

4,6-Dichloronicotinic acid73027-79-961 % similar 5-Amino-2-chloroisonicotinic acid58483-95-757 % similar 2,4,5-Trimethoxybenzoic acid490-64-257 % similar 2,5-Dichloroisonicotinic acid88912-26-956 % similar 4-Chloro-2-methoxybenzoic acid57479-70-656 % similar 4-Amino-5-chloro-2-methoxybenzoic acid7206-70-455 % similar 5-Chloro-2-methoxybenzoic acid3438-16-252 % similar 2-Amino-4,5-dimethoxybenzoic acid5653-40-751 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Chloro-2-methoxy-4-nitrobenzene1009-36-5 1-Chloro-4-methoxy-2-nitrobenzene10298-80-3 4-Chloro-2-nitrobenzenemethanol22996-18-5 2-(Chloromethyl)-4-nitrophenol2973-19-5 2-Chloro-6-methyl-3-nitrophenol39183-20-5 2-Chloro-1-methoxy-4-nitrobenzene4920-79-0 4-Chloro-3-nitrobenzenemethanol55912-20-4 4-Chloro-2-methoxy-1-nitrobenzene6627-53-8

Elsewhere

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