Cas no 918663-85-1 (Octanedioic acid, 2-(acetylamino)-, (2R)-)

Octanedioic acid, 2-(acetylamino)-, (2R)- structure
918663-85-1 structure
Product Name:Octanedioic acid, 2-(acetylamino)-, (2R)-
CAS No:918663-85-1
MF:C10H17NO5
MW:231.245683431625
CID:771727
PubChem ID:71426493
Update Time:2025-04-19

Octanedioic acid, 2-(acetylamino)-, (2R)- Chemical and Physical Properties

Names and Identifiers

    • Octanedioic acid, 2-(acetylamino)-, (2R)-
    • (2R)-2-acetamidooctanedioic acid
    • DTXSID40845250
    • 918663-85-1
    • Inchi: 1S/C10H17NO5/c1-7(12)11-8(10(15)16)5-3-2-4-6-9(13)14/h8H,2-6H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t8-/m1/s1
    • InChI Key: GMOIZSZJPCCOBS-MRVPVSSYSA-N
    • SMILES: OC([C@@H](CCCCCC(=O)O)NC(C)=O)=O

Computed Properties

  • Exact Mass: 231.11067264g/mol
  • Monoisotopic Mass: 231.11067264g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 8
  • Complexity: 264
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.3
  • Topological Polar Surface Area: 104?2
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