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

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 1,527 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P317, P303+P361+P353, P330, P370+P378, P403+P235, P501

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

1,3-Thiazol-2-ylmethanol14542-12-250 % similar 2-Isobutylthiazole18640-74-950 % similar (2-Thiazolyl)methylamine55661-33-150 % similar 3-(2-Thiazolyl)propionic acid144163-65-547 % similar 2-Ethoxythiazole15679-19-342 % similar 2-Methylthiazole3581-87-141 % similar 2-Propylthiophene1551-27-539 % similar 2-sec-Butylthiazole18277-27-538 % 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-methyl thiazole15679-12-6 Thiopheneethanamine30433-91-1 Cyclopentyl isothiocyanate33522-03-1 2-(3-Thienyl)ethanamine59311-67-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook