ChemSpider 2D Image | Methyl 1-benzyl-1H-benzimidazole-5-carboxylate | C16H14N2O2

Methyl 1-benzyl-1H-benzimidazole-5-carboxylate

  • Molecular FormulaC16H14N2O2
  • Average mass266.295 Da
  • Monoisotopic mass266.105530 Da
  • ChemSpider ID27558270

More details:

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

1-Benzyl-1H-benzimidazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxylic acid, 1-(phenylmethyl)-, methyl ester [ACD/Index Name]
Methyl 1-benzyl-1H-benzimidazole-5-carboxylate [ACD/IUPAC Name]
Methyl-1-benzyl-1H-benzimidazol-5-carboxylat [German] [ACD/IUPAC Name]
[185428-95-9] [RN]
1-(Phenylsulfinyl)piperidine [ACD/IUPAC Name]
1199773-31-3 [RN]
185428-95-9 [RN]
IN-0343
methyl 1-benzyl-1,3-benzodiazole-5-carboxylate
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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: 1.2±0.1 g/cm3
    Boiling Point: 452.5±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.2±3.0 kJ/mol
    Flash Point: 227.5±29.3 °C
    Index of Refraction: 1.614
    Molar Refractivity: 77.7±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.22
    ACD/LogD (pH 5.5): 3.10
    ACD/BCF (pH 5.5): 132.81
    ACD/KOC (pH 5.5): 1142.86
    ACD/LogD (pH 7.4): 3.11
    ACD/BCF (pH 7.4): 136.51
    ACD/KOC (pH 7.4): 1174.69
    Polar Surface Area: 44 Å2
    Polarizability: 30.8±0.5 10-24cm3
    Surface Tension: 45.4±7.0 dyne/cm
    Molar Volume: 223.1±7.0 cm3

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