Cas no 507-71-1 (2, 3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid)

2, 3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid structure
507-71-1 structure
Product Name:2, 3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid
CAS No:507-71-1
MF:C7H14O5
MW:178.183063030243
CID:1997684
PubChem ID:12312695
Update Time:2025-04-21

2, 3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid Chemical and Physical Properties

Names and Identifiers

    • 2, 3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid
    • 2,3-Dihydroxy-2-(1-hydroxy-aethyl)-3-methyl-buttersaeure
    • 2,3-dihydroxy-2-(1-hydroxy-ethyl)-3-methyl-butyric acid
    • Asperumic acid-2, 3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid
    • Asperuminic-acid
    • Echimidinsaeure
    • 507-71-1
    • 2,3,4-trihydroxy-2-methylpe ntane-3-carboxylic
    • Butanoic acid, 2,3-dihydroxy-2-(1-hydroxyethyl)-3-methyl-
    • DB-260313
    • DTXSID901197710
    • 2,3-Dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid
    • 54324-53-7
    • Inchi: 1S/C7H14O5/c1-4(8)7(12,5(9)10)6(2,3)11/h4,8,11-12H,1-3H3,(H,9,10)
    • InChI Key: CJGZGQRVLCMUEG-UHFFFAOYSA-N
    • SMILES: CC(C(C(O)(C)C)(C(=O)O)O)O

Computed Properties

  • Exact Mass: 178.08412354Da
  • Monoisotopic Mass: 178.08412354Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 188
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.3
  • Topological Polar Surface Area: 98?2
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