Cas no 169908-36-5 (4-Thiazolidinecarboxylic acid, 2-(1-methylethyl)-, methyl ester, (2R,4R)-)

4-Thiazolidinecarboxylic acid, 2-(1-methylethyl)-, methyl ester, (2R,4R)- structure
169908-36-5 structure
Product Name:4-Thiazolidinecarboxylic acid, 2-(1-methylethyl)-, methyl ester, (2R,4R)-
CAS No:169908-36-5
MF:C8H15NO2S
MW:189.27520108223
CID:1351412
Update Time:2024-08-17

4-Thiazolidinecarboxylic acid, 2-(1-methylethyl)-, methyl ester, (2R,4R)- Chemical and Physical Properties

Names and Identifiers

    • 4-Thiazolidinecarboxylic acid, 2-(1-methylethyl)-, methyl ester, (2R,4R)-
    • Inchi: 1S/C8H15NO2S/c1-5(2)7-9-6(4-12-7)8(10)11-3/h5-7,9H,4H2,1-3H3/t6-,7+/m0/s1
    • InChI Key: HFAMQEIRUQNGKY-NKWVEPMBSA-N
    • SMILES: S1C[C@@H](C(OC)=O)N[C@H]1C(C)C

Computed Properties

  • Exact Mass: 189.08245

Experimental Properties

  • Density: 1.088±0.06 g/cm3(Predicted)
  • Boiling Point: 270.5±35.0 °C(Predicted)
  • PSA: 38.33
  • pka: 6.70±0.60(Predicted)
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