ChemSpider 2D Image | (5R)-5-(3-Aminopropyl)-1-propyl-4,5,6,7-tetrahydro-1H-benzimidazole-5-carboxylic acid | C14H23N3O2

(5R)-5-(3-Aminopropyl)-1-propyl-4,5,6,7-tetrahydro-1H-benzimidazole-5-carboxylic acid

  • Molecular FormulaC14H23N3O2
  • Average mass265.351 Da
  • Monoisotopic mass265.179016 Da
  • ChemSpider ID34235283

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5R)-5-(3-Aminopropyl)-1-propyl-4,5,6,7-tetrahydro-1H-benzimidazol-5-carbonsäure [German] [ACD/IUPAC Name]
(5R)-5-(3-Aminopropyl)-1-propyl-4,5,6,7-tetrahydro-1H-benzimidazole-5-carboxylic acid [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxylic acid, 5-(3-aminopropyl)-4,5,6,7-tetrahydro-1-propyl-, (5R)- [ACD/Index Name]
Acide (5R)-5-(3-aminopropyl)-1-propyl-4,5,6,7-tétrahydro-1H-benzimidazole-5-carboxylique [French] [ACD/IUPAC Name]
2B8

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

Density: 1.3±0.1 g/cm3
Boiling Point: 503.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.3±3.0 kJ/mol
Flash Point: 258.1±30.1 °C
Index of Refraction: 1.603
Molar Refractivity: 72.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): -2.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 212.3±7.0 cm3

Click to predict properties on the Chemicalize site


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