ChemSpider 2D Image | 3-(3-Chloro-1H-1,2,4-triazol-5-yl)-N-(2-methyl-2H-benzotriazol-5-yl)propanamide | C12H12ClN7O

3-(3-Chloro-1H-1,2,4-triazol-5-yl)-N-(2-methyl-2H-benzotriazol-5-yl)propanamide

  • Molecular FormulaC12H12ClN7O
  • Average mass305.723 Da
  • Monoisotopic mass305.079193 Da
  • ChemSpider ID114945500

More details:

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

1H-1,2,4-Triazole-5-propanamide, 3-chloro-N-(2-methyl-2H-1,2,3-benzotriazol-5-yl)- [ACD/Index Name]
3-(3-Chlor-1H-1,2,4-triazol-5-yl)-N-(2-methyl-2H-benzotriazol-5-yl)propanamid [German] [ACD/IUPAC Name]
3-(3-Chloro-1H-1,2,4-triazol-5-yl)-N-(2-methyl-2H-benzotriazol-5-yl)propanamide [ACD/IUPAC Name]
3-(3-Chloro-1H-1,2,4-triazol-5-yl)-N-(2-méthyl-2H-benzotriazol-5-yl)propanamide [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.781
Molar Refractivity: 77.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 5.03
ACD/KOC (pH 5.5): 110.61
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 4.72
ACD/KOC (pH 7.4): 103.80
Polar Surface Area: 101 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 68.8±7.0 dyne/cm
Molar Volume: 185.1±7.0 cm3

Click to predict properties on the Chemicalize site


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