Cas no 305346-87-6 (1H-Benzimidazole,1-(3-methylbutyl)-)

1H-Benzimidazole,1-(3-methylbutyl)- structure
305346-87-6 structure
Product Name:1H-Benzimidazole,1-(3-methylbutyl)-
CAS No:305346-87-6
MF:C12H16N2
MW:188.268842697144
CID:299825
Update Time:2024-01-27

1H-Benzimidazole,1-(3-methylbutyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazole,1-(3-methylbutyl)-
    • 1H-Benzimidazole,1-(3-methylbutyl)-(9CI)
    • 1-(3-Methylbutyl)-1H-benzimidazole
    • 1H-Benzimidazole, 1-(3-methylbutyl)-
    • Inchi: 1S/C12H16N2/c1-10(2)7-8-14-9-13-11-5-3-4-6-12(11)14/h3-6,9-10H,7-8H2,1-2H3
    • InChI Key: VQHDTNKPHBMTIK-UHFFFAOYSA-N
    • SMILES: C1N(CCC(C)C)C2=CC=CC=C2N=1

Computed Properties

  • Exact Mass: 188.13148

Experimental Properties

  • Density: 1.03±0.1 g/cm3(Predicted)
  • Boiling Point: 305.4±25.0 °C(Predicted)
  • PSA: 17.82
  • pka: 5.48±0.10(Predicted)
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