Cas no 819872-20-3 (1H-Benzimidazole-2-carboxaldehyde, 1-(3-butenyl)-)

1H-Benzimidazole-2-carboxaldehyde, 1-(3-butenyl)- structure
819872-20-3 structure
Product Name:1H-Benzimidazole-2-carboxaldehyde, 1-(3-butenyl)-
CAS No:819872-20-3
MF:C12H12N2O
MW:200.236482620239
CID:701814
PubChem ID:71420613
Update Time:2025-04-19

1H-Benzimidazole-2-carboxaldehyde, 1-(3-butenyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazole-2-carboxaldehyde, 1-(3-butenyl)-
    • 1-but-3-enylbenzimidazole-2-carbaldehyde
    • 819872-20-3
    • 1-(But-3-en-1-yl)-1H-benzimidazole-2-carbaldehyde
    • DTXSID20839798
    • Inchi: 1S/C12H12N2O/c1-2-3-8-14-11-7-5-4-6-10(11)13-12(14)9-15/h2,4-7,9H,1,3,8H2
    • InChI Key: WTFKFXSXTFVJKG-UHFFFAOYSA-N
    • SMILES: O=CC1=NC2C=CC=CC=2N1CCC=C

Computed Properties

  • Exact Mass: 200.094963011g/mol
  • Monoisotopic Mass: 200.094963011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 242
  • 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: 2.3
  • Topological Polar Surface Area: 34.9?2
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