ChemSpider 2D Image | 4-(2-Methyl-1H-benzimidazol-1-yl)benzoic acid | C15H12N2O2

4-(2-Methyl-1H-benzimidazol-1-yl)benzoic acid

  • Molecular FormulaC15H12N2O2
  • Average mass252.268 Da
  • Monoisotopic mass252.089874 Da
  • ChemSpider ID24063581

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-(2-Methyl-1H-benzimidazol-1-yl)benzoesäure [German] [ACD/IUPAC Name]
4-(2-Methyl-1H-benzimidazol-1-yl)benzoic acid [ACD/IUPAC Name]
Acide 4-(2-méthyl-1H-benzimidazol-1-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(2-methyl-1H-benzimidazol-1-yl)- [ACD/Index Name]
MFCD13810991 [MDL number]
[1021144-32-0] [RN]
[102120-95-6] [RN]
1021144-32-0 [RN]
102120-95-6 [RN]
4-(2-METHYL-1,3-BENZODIAZOL-1-YL)BENZOIC ACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 486.2±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.2±3.0 kJ/mol
    Flash Point: 247.8±29.3 °C
    Index of Refraction: 1.655
    Molar Refractivity: 72.6±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.56
    ACD/LogD (pH 5.5): 1.50
    ACD/BCF (pH 5.5): 3.21
    ACD/KOC (pH 5.5): 26.66
    ACD/LogD (pH 7.4): 0.25
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.49
    Polar Surface Area: 55 Å2
    Polarizability: 28.8±0.5 10-24cm3
    Surface Tension: 50.4±7.0 dyne/cm
    Molar Volume: 197.8±7.0 cm3

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