Cas no 5523-13-7 (2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol)

2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol structure
5523-13-7 structure
Product Name:2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol
CAS No:5523-13-7
MF:C12H17N3O
MW:219.282882452011
CID:1595396
PubChem ID:2849631
Update Time:2025-04-21

2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol Chemical and Physical Properties

Names and Identifiers

    • 2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol
    • Ethanol, 2-[(1-propyl-1H-benzimidazol-2-yl)amino]-
    • CS-0216575
    • DTXSID20970554
    • ALBB-017607
    • LS-05779
    • MLS000595352
    • 5523-13-7
    • Oprea1_197316
    • 2-[(1-propylbenzimidazol-2-yl)amino]ethanol
    • 2-((1-Propyl-1H-benzo[d]imidazol-2-yl)amino)ethanol
    • Z57299366
    • AKOS002255606
    • 111678-86-5
    • BIM-0022502.P001
    • CHEMBL1517899
    • STK008519
    • 2-[(1-Propyl-1,3-dihydro-2H-benzimidazol-2-ylidene)amino]ethan-1-ol
    • SMR000149875
    • 2-[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]ethan-1-ol
    • EN300-51640
    • Cambridge id 5523137
    • 2-(1-Propyl-1H-benzoimidazol-2-ylamino)-ethanol
    • G42749
    • HMS2486N22
    • CCG-9730
    • MFCD01136089
    • CBMicro_022644
    • Inchi: 1S/C12H17N3O/c1-2-8-15-11-6-4-3-5-10(11)14-12(15)13-7-9-16/h3-6,16H,2,7-9H2,1H3,(H,13,14)
    • InChI Key: UKANTQXTRJQTAF-UHFFFAOYSA-N
    • SMILES: OCCNC1=NC2C=CC=CC=2N1CCC

Computed Properties

  • Exact Mass: 219.13731
  • Monoisotopic Mass: 219.137
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 212
  • 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: 1.9
  • Topological Polar Surface Area: 50.1?2

Experimental Properties

  • Density: 1.18
  • Boiling Point: 399.2°C at 760 mmHg
  • Flash Point: 195.2°C
  • Refractive Index: 1.6
  • PSA: 50.08
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