ChemSpider 2D Image | 2-[(4-Tert-Butylphenyl)amino]-1h-Benzimidazole-6-Carbonitrile | C18H18N4

2-[(4-Tert-Butylphenyl)amino]-1h-Benzimidazole-6-Carbonitrile

  • Molecular FormulaC18H18N4
  • Average mass290.362 Da
  • Monoisotopic mass290.153137 Da
  • ChemSpider ID27785161

More details:






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

1H-Benzimidazole-5-carbonitrile, 2-[[4-(1,1-dimethylethyl)phenyl]amino]- [ACD/Index Name]
2-[(4-Tert-Butylphenyl)amino]-1h-Benzimidazole-6-Carbonitrile
2-{[4-(2-Methyl-2-propanyl)phenyl]amino}-1H-benzimidazol-5-carbonitril [German] [ACD/IUPAC Name]
2-{[4-(2-Methyl-2-propanyl)phenyl]amino}-1H-benzimidazole-5-carbonitrile [ACD/IUPAC Name]
2-{[4-(2-Méthyl-2-propanyl)phényl]amino}-1H-benzimidazole-5-carbonitrile [French] [ACD/IUPAC Name]
0VN
2-(4-tert-butylanilino)-3H-benzimidazole-5-carbonitrile
Benzoic acid, 4-(aminomethyl)- (9CI)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 494.7±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.2±3.0 kJ/mol
Flash Point: 253.0±29.3 °C
Index of Refraction: 1.652
Molar Refractivity: 87.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 4.46
ACD/BCF (pH 5.5): 1361.92
ACD/KOC (pH 5.5): 5640.60
ACD/LogD (pH 7.4): 4.58
ACD/BCF (pH 7.4): 1775.24
ACD/KOC (pH 7.4): 7352.39
Polar Surface Area: 65 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 61.5±5.0 dyne/cm
Molar Volume: 239.2±5.0 cm3

Click to predict properties on the Chemicalize site






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