ChemSpider 2D Image | N-[1-(4-Bromobenzyl)-1H-1,2,4-triazol-3-yl]-7-chloro-3-methyl-1-benzofuran-2-carboxamide | C19H14BrClN4O2

N-[1-(4-Bromobenzyl)-1H-1,2,4-triazol-3-yl]-7-chloro-3-methyl-1-benzofuran-2-carboxamide

  • Molecular FormulaC19H14BrClN4O2
  • Average mass445.697 Da
  • Monoisotopic mass443.998871 Da
  • ChemSpider ID34338635

More details:

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

2-Benzofurancarboxamide, N-[1-[(4-bromophenyl)methyl]-1H-1,2,4-triazol-3-yl]-7-chloro-3-methyl- [ACD/Index Name]
N-[1-(4-Brombenzyl)-1H-1,2,4-triazol-3-yl]-7-chlor-3-methyl-1-benzofuran-2-carboxamid [German] [ACD/IUPAC Name]
N-[1-(4-Bromobenzyl)-1H-1,2,4-triazol-3-yl]-7-chloro-3-methyl-1-benzofuran-2-carboxamide [ACD/IUPAC Name]
N-[1-(4-Bromobenzyl)-1H-1,2,4-triazol-3-yl]-7-chloro-3-méthyl-1-benzofurane-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.712
Molar Refractivity: 107.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 3020.31
ACD/KOC (pH 5.5): 10778.78
ACD/LogD (pH 7.4): 4.88
ACD/BCF (pH 7.4): 3017.56
ACD/KOC (pH 7.4): 10768.98
Polar Surface Area: 73 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 56.7±7.0 dyne/cm
Molar Volume: 274.0±7.0 cm3

Click to predict properties on the Chemicalize site


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