chempirical

2-Propylthiazole

C6H9NSCAS 17626-75-4127.20 g/mol

Open in Covalent MOL file
NS

Properties

Molecular formula
C6H9NS
Molar mass
127.20 g/mol
Exact mass
127.0456 Da
logP
2.10Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
17626-75-4
SMILES
CCCc1nccs1
InChIKey
CMOIEFFAOUQJPS-UHFFFAOYSA-N
InChI
InChI=1S/C6H9NS/c1-2-3-6-7-4-5-8-6/h4-5H,2-3H2,1H3

Weigh it out

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

Names and synonyms

3 names
  • Thiazole, 2-propyl-
  • 2-n-Propylthiazole
  • 2-Propyl-1,3-thiazole

Work with 2-Propylthiazole

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-Isobutylthiazole18640-74-950 % similar 2-Ethoxythiazole15679-19-342 % similar 2-Methylthiazole3581-87-141 % similar 2-Propylthiophene1551-27-539 % similar 2-sec-Butylthiazole18277-27-538 % similar 4-Propylpyridine1122-81-238 % similar 2-Methyl-3-propylpyrazine15986-80-838 % similar Propylpyrazine18138-03-938 % similar

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

Same formula

(3-Methyl-2-thienyl)methylamine104163-35-1 2,4,5-Trimethylthiazole13623-11-5 2-Ethyl-4-methylthiazole15679-12-6 2-Thiopheneethanamine30433-91-1

Elsewhere

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