Methyl 5-fluoropyridine-2-carboxylate

C₇H₆FNO₂CAS 107504-07-4155.13 g/mol

Open in Covalent MOL file

Aryl halide Ester

Properties

Molecular formula: C₇H₆FNO₂
Molar mass: 155.13 g/mol
Exact mass: 155.0383 Da
logP: 1.01Crippen estimate
Polar surface area: 39.2 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

107504-07-4

SMILES

COC(=O)c1ccc(F)cn1

InChIKey

KCMBKUFSDZMQEM-UHFFFAOYSA-N

InChI

InChI=1S/C7H6FNO2/c1-11-7(10)6-3-2-5(8)4-9-6/h2-4H,1H3

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Names and synonyms

2 names

2-Pyridinecarboxylic acid, 5-fluoro-, methyl ester
5-Fluoropyridine-2-carboxylic acid methyl ester

Work with Methyl 5-fluoropyridine-2-carboxylate

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

5-Bromopyridine-2-carboxylic acid methyl ester29682-15-361 % similar Methyl 5-hydroxy-2-pyridinecarboxylate30766-12-261 % similar Methyl 4-fluorobenzoate403-33-856 % similar 5-Fluoropyridine-2-carboxylic acid107504-08-553 % similar Methyl picolinate2459-07-653 % similar Methyl 3-isoquinolinecarboxylate27104-73-051 % similar Methyl5-fluoro-6-methylpicolinate1245647-61-350 % similar 5-Methyl 2,5-pyridinedicarboxylate17874-79-249 % similar

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

Same formula

2-Fluoro-1-methyl-4-nitrobenzene1427-07-2 3-Amino-4-fluorobenzoic acid2365-85-7 2-Amino-5-fluorobenzoic acid446-08-2 4-Fluoro-1-methyl-2-nitrobenzene446-10-6 2-Amino-4-fluorobenzoic acid446-32-2 4-Fluoro-2-methyl-1-nitrobenzene446-33-3 2-Fluoro-4-methyl-1-nitrobenzene446-34-4 6-Fluoropyridine-2-carboxylic acid methyl ester455-71-0

Elsewhere

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