ChemSpider 2D Image | 1-[(2,6-Difluorophenyl)(~2~H_2_)methyl]-1H-1,2,3-triazole-4-carboxamide | C10H6D2F2N4O

1-[(2,6-Difluorophenyl)(2H2)methyl]-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC10H6D2F2N4O
  • Average mass240.206 Da
  • Monoisotopic mass240.079178 Da
  • ChemSpider ID76842823

  • Non-standard isotope - Non-standard isotope

More details:

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

1-[(2,6-Difluorophenyl)(2H2)methyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
1-[(2,6-Difluorophényl)(2H2)méthyl]-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1-[(2,6-Difluorphenyl)(2H2)methyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxamide, 1-[(2,6-difluorophenyl)methyl-d2]- [ACD/Index Name]
170939-95-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 473.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 240.4±31.5 °C
Index of Refraction: 1.635
Molar Refractivity: 56.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.05
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.22
ACD/KOC (pH 5.5): 40.23
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.22
ACD/KOC (pH 7.4): 40.23
Polar Surface Area: 74 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 156.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement