Cas no 61798-00-3 (Nonanoic acid,9-amino-9-oxo-)

Nonanoic acid,9-amino-9-oxo- structure
Nonanoic acid,9-amino-9-oxo- structure
Product Name:Nonanoic acid,9-amino-9-oxo-
CAS No:61798-00-3
MF:C9H17NO3
MW:187.236182928085
MDL:MFCD20639399
CID:525286
PubChem ID:258338
Update Time:2025-04-19

Nonanoic acid,9-amino-9-oxo- Chemical and Physical Properties

Names and Identifiers

    • Nonanoic acid,9-amino-9-oxo-
    • 9-amino-9-oxononanoic acid
    • Azelaamic acid
    • Nonanoic acid,9-amino-9-oxo
    • NSC-87152
    • 61798-00-3
    • NSC87152
    • AKOS040737026
    • AS-78428
    • DTXSID90293085
    • SCHEMBL125909
    • 8-carbamoyloctan-saure
    • Compound NP-024694
    • D97249
    • 8-carbamoyloctanoic acid
    • MDL: MFCD20639399
    • Inchi: 1S/C9H17NO3/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H2,10,11)(H,12,13)
    • InChI Key: DJKLLZJDRPGBPJ-UHFFFAOYSA-N
    • SMILES: NC(CCCCCCCC(=O)O)=O

Computed Properties

  • Exact Mass: 187.12100
  • Monoisotopic Mass: 187.12084340g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 8
  • Complexity: 168
  • 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: 0.9
  • Topological Polar Surface Area: 80.4?2

Experimental Properties

  • PSA: 80.39000
  • LogP: 1.98730

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