Cas no 110925-53-6 (2-(1H-1,3-benzodiazol-5-yl)ethan-1-amine)

2-(1H-1,3-benzodiazol-5-yl)ethan-1-amine structure
110925-53-6 structure
Product Name:2-(1H-1,3-benzodiazol-5-yl)ethan-1-amine
CAS No:110925-53-6
MF:C9H11N3
MW:161.203741312027
MDL:MFCD11656569
CID:136247
PubChem ID:10374733
Update Time:2025-04-19

2-(1H-1,3-benzodiazol-5-yl)ethan-1-amine Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazole-5-ethanamine(9CI)
    • 1H-Benzimidazole-5-ethanamine
    • 1H-Benzimidazole-6-ethanamine
    • 2-(1H-BENZO[D]IMIDAZOL-5-YL)ETHANAMINE
    • 2-(3H-benzimidazol-5-yl)ethanamine
    • 2-(1H-Benzoimidazol-5-yl)-ethylamine
    • 2-(1H-1,3-benzodiazol-5-yl)ethan-1-amine
    • DTXSID00438824
    • SCHEMBL12569410
    • SCHEMBL17195989
    • SB30675
    • 2-(1H-Benzo[d]imidazol-6-yl)ethanamine
    • 110925-53-6
    • EN300-1228638
    • 2-(1H-benzo[d]imidazol-6-yl)ethan-1-amine
    • AKOS015911735
    • 2-(1H-Benzimidazol-6-yl)ethan-1-amine
    • 2-(1H-1,3-benzodiazol-6-yl)ethan-1-amine
    • CS-0270659
    • DB-103236
    • MDL: MFCD11656569
    • Inchi: 1S/C9H11N3/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5-6H,3-4,10H2,(H,11,12)
    • InChI Key: GQLYNPJBFLEOIS-UHFFFAOYSA-N
    • SMILES: N1C=NC2=CC=C(C=C12)CCN

Computed Properties

  • Exact Mass: 161.09543
  • Monoisotopic Mass: 161.095297364g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 149
  • 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: 0.6
  • Topological Polar Surface Area: 54.7?2

Experimental Properties

  • PSA: 54.7
  • LogP: 1.76440

2-(1H-1,3-benzodiazol-5-yl)ethan-1-amine Pricemore >>

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