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Search term: 139481-72-4 (Found by approved synonym)

ChemSpider 2D Image | Trityl candesartan | C43H34N6O3

Trityl candesartan

  • Molecular FormulaC43H34N6O3
  • Average mass682.768 Da
  • Monoisotopic mass682.269226 Da
  • ChemSpider ID8488029

More details:






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

139481-72-4 [RN]
1H-Benzimidazole-7-carboxylic acid, 2-ethoxy-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]- [ACD/Index Name]
2-Ethoxy-1-{[2'-(1-trityl-1H-tetrazol-5-yl)-4-biphenylyl]methyl}-1H-benzimidazol-7-carbonsäure [German] [ACD/IUPAC Name]
2-Ethoxy-1-{[2'-(1-trityl-1H-tetrazol-5-yl)-4-biphenylyl]methyl}-1H-benzimidazole-7-carboxylic acid [ACD/IUPAC Name]
2-Ethoxy-1-{[2'-(1-trityl-1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-benzimidazole-7-carboxylic acid
Acide 2-éthoxy-1-{[2'-(1-trityl-1H-tétrazol-5-yl)-4-biphénylyl]méthyl}-1H-benzimidazole-7-carboxylique [French] [ACD/IUPAC Name]
N-Trityl Candesartan
Trityl candesartan
(Trityl candesartan)2-Ethoxy-1-[[2-(2-Triphenyl Methyl)-2H-Tetrazole-5-YL](1,1-Biphenyl)-4-YL]Methyl]Benzimidazole-2-Carboxylic Acid
[139481-72-4] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 908.6±75.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 138.4±3.0 kJ/mol
    Flash Point: 503.3±37.1 °C
    Index of Refraction: 1.678
    Molar Refractivity: 203.9±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 10.15
    ACD/LogD (pH 5.5): 6.35
    ACD/BCF (pH 5.5): 12046.70
    ACD/KOC (pH 5.5): 7181.72
    ACD/LogD (pH 7.4): 5.43
    ACD/BCF (pH 7.4): 1468.71
    ACD/KOC (pH 7.4): 875.58
    Polar Surface Area: 108 Å2
    Polarizability: 80.8±0.5 10-24cm3
    Surface Tension: 53.3±7.0 dyne/cm
    Molar Volume: 540.9±7.0 cm3

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