2-Ethyl-4,5-dimethylthiazole

C₇H₁₁NSCAS 873-64-3141.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₁NS
Molar mass: 141.23 g/mol
Exact mass: 141.0612 Da
Boiling point: 63–64 °C (at 3 Torr)
logP: 2.32Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

873-64-3

SMILES

CCc1nc(C)c(C)s1

InChIKey

BVOKJOZBJOWZNJ-UHFFFAOYSA-N

InChI

InChI=1S/C7H11NS/c1-4-7-8-5(2)6(3)9-7/h4H2,1-3H3

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

Names and synonyms

3 names

Thiazole, 2-ethyl-4,5-dimethyl-
4,5-Dimethyl-2-ethylthiazole
2-Ethyl-4,5-dimethyl-1,3-thiazole

Work with 2-Ethyl-4,5-dimethylthiazole

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-Isobutyl-4,5-dimethylthiazole53498-32-157 % similar 2,4,5-Trimethylthiazole13623-11-548 % similar 4,5-Dimethyl-2-(1-methylethyl)thiazole53498-30-943 % similar 2-Ethyl-4-methylthiazole15679-12-638 % similar 2,3-Dimethyl-5-ethylpyrazine15707-34-334 % similar 2-Amino-5-ethyl-1,3,4-thiadiazole14068-53-232 % similar 2-Ethyl-3,5-dimethylpyrazine13925-07-031 % similar 2-Ethyl-3-methylpyrazine15707-23-031 % similar

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

Same formula

Cyclohexyl isothiocyanate1122-82-3 2-Isopropyl-4-methylthiazole15679-13-7 2-sec-Butylthiazole18277-27-5 2-Isobutylthiazole18640-74-9

Elsewhere

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