Methyl 5-fluoropyridine-2-carboxylate

C7H6FNO2CAS 107504-07-4155.13 g/mol

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OOFN
Aryl halideEster

Properties

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

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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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

Dimethyl pyridine-2,5-dicarboxylate881-86-765 % similar Methyl 5-bromopyridine-2-carboxylate29682-15-361 % similar Methyl 5-hydroxypyridine-2-carboxylate30766-12-261 % similar Methyl 5-formylpyridine-2-carboxylate55876-91-058 % similar Methyl 4-fluorobenzoate403-33-856 % similar Pyrimidine-4-carboxylic acid methyl ester2450-08-056 % similar 5-Fluoropyridine-2-carboxylic acid107504-08-553 % similar Methyl picolinate2459-07-653 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Fluoronicotinic acid methyl ester1427-06-1 2-Fluoro-1-methyl-4-nitrobenzene1427-07-2 3-Amino-4-fluorobenzoic acid2365-85-7 1-Fluoro-3-methyl-2-nitrobenzene3013-27-2 5-Fluoro-2-methoxynicotinaldehyde351410-62-3 2-Amino-6-fluorobenzoic acid434-76-4 2-Fluoro-1-methyl-3-nitrobenzene437-86-5 2-Amino-5-fluorobenzoic acid446-08-2

Elsewhere

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