Cas no 89582-46-7 (Hexanoic acid,2,5-diamino-6-hydroxy- (7CI))

Hexanoic acid,2,5-diamino-6-hydroxy- (7CI) structure
89582-46-7 structure
Product Name:Hexanoic acid,2,5-diamino-6-hydroxy- (7CI)
CAS No:89582-46-7
MF:C6H14N2O3
MW:162.186961650848
CID:712025
Update Time:2024-01-31

Hexanoic acid,2,5-diamino-6-hydroxy- (7CI) Chemical and Physical Properties

Names and Identifiers

    • Hexanoic acid,2,5-diamino-6-hydroxy- (7CI)
    • Hexanoic acid, 2,5-diamino-6-hydroxy- (7CI)
    • Inchi： 1S/C6H14N2O3/c7-4(3-9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)
    • InChI Key： QHWULKOMKLEHTD-UHFFFAOYSA-N
    • SMILES： C(O)(=O)C(N)CCC(N)CO

Computed Properties

  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 348
  • 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
  • Surface Charge: 0
  • Tautomer Count: 175
  • XLogP3: 2.3

Hexanoic acid,2,5-diamino-6-hydroxy- (7CI) Related Literature

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