chempirical

2,5-Dimethylthiazole

C5H7NSCAS 4175-66-0113.18 g/mol

Open in Covalent MOL file
NS

Properties

Molecular formula
C5H7NS
Molar mass
113.18 g/mol
Exact mass
113.0299 Da
Density
1.028 g/mL (at 21 °C)
Boiling point
153 °C (at 758 Torr)
logP
1.76Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
4175-66-0
SMILES
Cc1cnc(C)s1
InChIKey
WVUHHPQQQLBMOE-UHFFFAOYSA-N
InChI
InChI=1S/C5H7NS/c1-4-3-6-5(2)7-4/h3H,1-2H3

Weigh it out

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

Names and synonyms

2 names
  • Thiazole, 2,5-dimethyl-
  • 2,5-Dimethyl-1,3-thiazole

Work with 2,5-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-Methyl-5-methoxythiazole38205-64-048 % similar 2-Methylthiazole-5-carbaldehyde1003-60-746 % similar 2-Methyl-5-thiazolecarboxylic acid40004-69-142 % similar 2,5-Dimethyl-1,3,4-thiadiazole27464-82-036 % similar 2,5-Dimethylthiophene638-02-836 % similar 2-Methylthiazole3581-87-136 % similar 5-Methylthiazole3581-89-335 % similar 2,5-Dimethylpyrazine123-32-030 % similar

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

Same formula

2-Thiophenemethanamine27757-85-3 3-Thiophenemethanamine27757-86-4 4,5-Dimethylthiazole3581-91-7 2,4-Dimethylthiazole541-58-2

Elsewhere

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