ChemSpider 2D Image | 4'-Chloro-2-({4-[1-cyclohexyl-5-(2H-tetrazol-5-yl)-1H-benzimidazol-2-yl]phenoxy}methyl)-4-biphenylcarboxylic acid | C34H29ClN6O3

4'-Chloro-2-({4-[1-cyclohexyl-5-(2H-tetrazol-5-yl)-1H-benzimidazol-2-yl]phenoxy}methyl)-4-biphenylcarboxylic acid

  • Molecular FormulaC34H29ClN6O3
  • Average mass605.086 Da
  • Monoisotopic mass604.198975 Da
  • ChemSpider ID4983654

More details:

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

[1,1'-Biphenyl]-4-carboxylic acid, 4'-chloro-2-[[4-[1-cyclohexyl-5-(2H-tetrazol-5-yl)-1H-benzimidazol-2-yl]phenoxy]methyl]- [ACD/Index Name]
4'-Chlor-2-({4-[1-cyclohexyl-5-(2H-tetrazol-5-yl)-1H-benzimidazol-2-yl]phenoxy}methyl)-4-biphenylcarbonsäure [German] [ACD/IUPAC Name]
4'-Chloro-2-({4-[1-cyclohexyl-5-(2H-tetrazol-5-yl)-1H-benzimidazol-2-yl]phenoxy}methyl)-4-biphenylcarboxylic acid [ACD/IUPAC Name]
Acide 4'-chloro-2-({4-[1-cyclohexyl-5-(2H-tétrazol-5-yl)-1H-benzimidazol-2-yl]phénoxy}méthyl)-4-biphénylcarboxylique [French] [ACD/IUPAC Name]
[1,1'-biphenyl]-4-carboxylic acid, 4'-chloro-2-[[4-[1-cyclohexyl-5-(1H-tetrazol-5-yl)-1H-benzimidazol-2-yl]phenoxy]methyl]-

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

AIDS342930 [DBID]
AIDS-342930 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 873.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 133.0±3.0 kJ/mol
Flash Point: 482.1±37.1 °C
Index of Refraction: 1.725
Molar Refractivity: 168.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 9.30
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 191.76
ACD/KOC (pH 5.5): 210.84
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 14.37
ACD/KOC (pH 7.4): 15.80
Polar Surface Area: 119 Å2
Polarizability: 66.7±0.5 10-24cm3
Surface Tension: 59.2±7.0 dyne/cm
Molar Volume: 423.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement