Cas no 915922-01-9 (2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid)

2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid structure
915922-01-9 structure
Product Name:2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid
CAS No:915922-01-9
MF:C13H16N2O2
MW:232.278343200684
CID:1087142
PubChem ID:3890819
Update Time:2025-04-20

2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid
    • 2-(2-Propyl-1H-benzimidazol-1-yl)propanoic acid
    • AKOS022185248
    • 2-(2-propylbenzimidazol-1-yl)propanoic acid
    • 915922-01-9
    • AKOS000301859
    • HMS1701O15
    • MDL: MFCD07397339
    • Inchi: 1S/C13H16N2O2/c1-3-6-12-14-10-7-4-5-8-11(10)15(12)9(2)13(16)17/h4-5,7-9H,3,6H2,1-2H3,(H,16,17)
    • InChI Key: OFYZINWGFMTKOQ-UHFFFAOYSA-N
    • SMILES: OC(C(C)N1C2C=CC=CC=2N=C1CCC)=O

Computed Properties

  • Exact Mass: 232.121177757g/mol
  • Monoisotopic Mass: 232.121177757g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 283
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 55.1?2
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