Ethyl 2-(2,4-difluorophenyl)thiazole-4-carboxylate

C₁₂H₉F₂NO₂SCAS 175276-93-4269.27 g/mol

Open in Covalent MOL file

Aryl halide Ester

Properties

Molecular formula: C₁₂H₉F₂NO₂S
Molar mass: 269.27 g/mol
Exact mass: 269.0322 Da
logP: 3.27Crippen estimate
Polar surface area: 39.2 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 3

Hazards

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

Identifiers

CAS number

175276-93-4

SMILES

CCOC(=O)c1csc(-c2ccc(F)cc2F)n1

InChIKey

QZWCWKKYIGCUOG-UHFFFAOYSA-N

InChI

InChI=1S/C12H9F2NO2S/c1-2-17-12(16)10-6-18-11(15-10)8-4-3-7(13)5-9(8)14/h3-6H,2H2,1H3

Weigh it out

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Names and synonyms

3 names

Ethyl 2-(2,4-difluorophenyl)-4-thiazolecarboxylate
4-Thiazolecarboxylic acid, 2-(2,4-difluorophenyl)-, ethyl ester
2-(2,4-Difluorophenyl)thiazole-4-carboxylic acid ethyl ester

Work with Ethyl 2-(2,4-difluorophenyl)thiazole-4-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

2-(2,4-Difluorophenyl)thiazole-4-carboxamide175276-97-862 % similar Ethyl 2,4-difluorobenzoate108928-00-360 % similar Ethyl 2-methylthiazole-4-carboxylate6436-59-549 % similar Ethyl 2-bromothiazole-4-carboxylate100367-77-948 % similar Ethyl 2-chloro-1,3-thiazole-4-carboxylate41731-52-648 % similar Ethyl 3-fluorobenzoate451-02-546 % similar Ethyl 4-fluorobenzoate451-46-746 % similar Ethyl o-fluorobenzoate443-26-544 % similar

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

Elsewhere

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