Cas no 148728-49-8 (5-Thiazoleacetic acid, 2-amino-4-(methoxycarbonyl)-, methyl ester)

5-Thiazoleacetic acid, 2-amino-4-(methoxycarbonyl)-, methyl ester structure
148728-49-8 structure
Product Name:5-Thiazoleacetic acid, 2-amino-4-(methoxycarbonyl)-, methyl ester
CAS No:148728-49-8
MF:C8H10N2O4S
MW:230.241000652313
CID:3780421
PubChem ID:20788332
Update Time:2025-04-22

5-Thiazoleacetic acid, 2-amino-4-(methoxycarbonyl)-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • 5-Thiazoleacetic acid, 2-amino-4-(methoxycarbonyl)-, methyl ester
    • 148728-49-8
    • Methyl 2-amino-4-(methoxycarbonyl)-5-thiazoleacetate
    • AKOS024385273
    • DTXSID501220490
    • Inchi: 1S/C8H10N2O4S/c1-13-5(11)3-4-6(7(12)14-2)10-8(9)15-4/h3H2,1-2H3,(H2,9,10)
    • InChI Key: UESQZSCEIUATLF-UHFFFAOYSA-N
    • SMILES: S1C(CC(OC)=O)=C(C(OC)=O)N=C1N

Computed Properties

  • Exact Mass: 230.03612798Da
  • Monoisotopic Mass: 230.03612798Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 261
  • 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: 0.6
  • Topological Polar Surface Area: 120?2
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