Cas no 1408075-35-3 (Methyl 2-formylthiazole-5-carboxylate)

Methyl 2-formylthiazole-5-carboxylate structure
1408075-35-3 structure
Product Name:Methyl 2-formylthiazole-5-carboxylate
CAS No:1408075-35-3
MF:C6H5NO3S
MW:171.173800230026
MDL:MFCD22414490
CID:4594847
PubChem ID:72207921
Update Time:2024-11-02

Methyl 2-formylthiazole-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • METHYL 2-FORMYLTHIAZOLE-5-CARBOXYLATE
    • METHYL 2-FORMYL-1,3-THIAZOLE-5-CARBOXYLATE
    • 5-Thiazolecarboxylic acid, 2-formyl-, methyl ester
    • Methyl 2-form ylthiazole-5-carboxylate
    • PB36994
    • SB20843
    • DB-209184
    • AS-51642
    • MFCD22414490
    • SCHEMBL16742919
    • AKOS024055489
    • METHYL2-FORMYLTHIAZOLE-5-CARBOXYLATE
    • EN300-332869
    • P13174
    • Z1504684458
    • CS-0049162
    • ITBUZSKNECHXNJ-UHFFFAOYSA-N
    • 1408075-35-3
    • Methyl 2-formylthiazole-5-carboxylate
    • MDL: MFCD22414490
    • Inchi: 1S/C6H5NO3S/c1-10-6(9)4-2-7-5(3-8)11-4/h2-3H,1H3
    • InChI Key: ITBUZSKNECHXNJ-UHFFFAOYSA-N
    • SMILES: S1C(C=O)=NC=C1C(=O)OC

Computed Properties

  • Exact Mass: 170.99901420 g/mol
  • Monoisotopic Mass: 170.99901420 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 173
  • 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: 0.9
  • Topological Polar Surface Area: 84.5
  • Molecular Weight: 171.18

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 301.4±34.0 °C at 760 mmHg
  • Flash Point: 136.1±25.7 °C
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

Methyl 2-formylthiazole-5-carboxylate Security Information

Methyl 2-formylthiazole-5-carboxylate Pricemore >>

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