ChemSpider 2D Image | N-(2-Bromophenyl)-4-[(3-methoxyphenyl)amino]-1H-1,2,3-triazole-5-carboxamide | C16H14BrN5O2

N-(2-Bromophenyl)-4-[(3-methoxyphenyl)amino]-1H-1,2,3-triazole-5-carboxamide

  • Molecular FormulaC16H14BrN5O2
  • Average mass388.219 Da
  • Monoisotopic mass387.033081 Da
  • ChemSpider ID22531247

More details:

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

1H-1,2,3-Triazole-4-carboxamide, N-(2-bromophenyl)-5-[(3-methoxyphenyl)amino]- [ACD/Index Name]
N-(2-Bromophenyl)-4-[(3-methoxyphenyl)amino]-1H-1,2,3-triazole-5-carboxamide [ACD/IUPAC Name]
N-(2-Bromophényl)-4-[(3-méthoxyphényl)amino]-1H-1,2,3-triazole-5-carboxamide [French] [ACD/IUPAC Name]
N-(2-Bromphenyl)-4-[(3-methoxyphenyl)amino]-1H-1,2,3-triazol-5-carboxamid [German] [ACD/IUPAC Name]
1105201-55-5 [RN]
5-(3-Methoxy-phenylamino)-1H-[1,2,3]triazole-4-carboxylic acid (2-bromo-phenyl)-amide
MFCD11997937
N-(2-bromophenyl)-5-((3-methoxyphenyl)amino)-1H-1,2,3-triazole-4-carboxamide
N-(2-bromophenyl)-5-[(3-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 502.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 257.4±30.1 °C
Index of Refraction: 1.727
Molar Refractivity: 95.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 3.23
ACD/BCF (pH 5.5): 164.59
ACD/KOC (pH 5.5): 1317.65
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 28.21
ACD/KOC (pH 7.4): 225.86
Polar Surface Area: 92 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 239.3±3.0 cm3

Click to predict properties on the Chemicalize site


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