Cas no 53498-31-0 (Thiazole,5-ethyl-4-methyl-2-(1-methylethyl)-)

Thiazole,5-ethyl-4-methyl-2-(1-methylethyl)- structure
53498-31-0 structure
Product Name:Thiazole,5-ethyl-4-methyl-2-(1-methylethyl)-
CAS No:53498-31-0
MF:C9H15NS
MW:169.28710103035
CID:375347
PubChem ID:3085038
Update Time:2025-04-19

Thiazole,5-ethyl-4-methyl-2-(1-methylethyl)- Chemical and Physical Properties

Names and Identifiers

    • Thiazole,5-ethyl-4-methyl-2-(1-methylethyl)-
    • 5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole
    • 5-Ethyl-2-isopropyl-4-methyl-1,3-thiazole
    • 53498-31-0
    • 5-Ethyl-4-methyl-2-(1-methylethyl)thiazole
    • 2-Isopropyl-4-methyl-5-ethylthiazole
    • SCHEMBL10129942
    • AKOS006371263
    • 5-Ethyl-2-isopropyl-4-methyl-thiazole
    • 5-ethyl-4-methyl-2-(propan-2-yl)-1,3-thiazole
    • DTXSID50201702
    • Thiazole, 5-ethyl-4-methyl-2-(1-methylethyl)-
    • AYEGWZGUAQDVNB-UHFFFAOYSA-N
    • 5-Ethyl-4-methyl-2-(1-methylethyl)-Thiazole
    • K6PX9H24Y6
    • 5-Ethyl-4-methyl-2-(1-methylethyl)thiazole, 9CI
    • Inchi: 1S/C9H15NS/c1-5-8-7(4)10-9(11-8)6(2)3/h6H,5H2,1-4H3
    • InChI Key: AYEGWZGUAQDVNB-UHFFFAOYSA-N
    • SMILES: S1C(CC)=C(C)N=C1C(C)C

Computed Properties

  • Exact Mass: 169.09265
  • Monoisotopic Mass: 169.093
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 125
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • Density: 0.988
  • Boiling Point: 225.3°Cat760mmHg
  • Flash Point: 83.3°C
  • Refractive Index: 1.51
  • PSA: 12.89
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