2-Ethyl-4,5-dimethylthiazole

C7H11NSCAS 873-64-3141.23 g/mol

Open in Covalent MOL file
NS

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 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 90 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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

Weigh it out

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-1,3-thiazol-2-amine2289-75-045 % similar 4,5-Dimethyl-2-(1-methylethyl)thiazole53498-30-943 % similar 2-Amino-4,5-dimethylthiazole hydrochloride71574-33-941 % similar 2-Ethyl-4-methyl thiazole15679-12-638 % similar 2,3-Dimethyl-5-ethylpyrazine15707-34-334 % similar 2-Amino-5-ethyl-1,3,4-thiadiazole14068-53-232 % 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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