ChemSpider 2D Image | 2-[(4-Cyanobenzyl)sulfonyl]-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]acetamide | C13H10F3N5O3S

2-[(4-Cyanobenzyl)sulfonyl]-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]acetamide

  • Molecular FormulaC13H10F3N5O3S
  • Average mass373.310 Da
  • Monoisotopic mass373.045654 Da
  • ChemSpider ID31583737

More details:

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

2-[(4-Cyanbenzyl)sulfonyl]-N-[3-(trifluormethyl)-1H-1,2,4-triazol-5-yl]acetamid [German] [ACD/IUPAC Name]
2-[(4-Cyanobenzyl)sulfonyl]-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]acetamide [ACD/IUPAC Name]
2-[(4-Cyanobenzyl)sulfonyl]-N-[3-(trifluorométhyl)-1H-1,2,4-triazol-5-yl]acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[(4-cyanophenyl)methyl]sulfonyl]-N-[5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]- [ACD/Index 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: 1.584
Molar Refractivity: 77.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.52
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.12
ACD/KOC (pH 5.5): 36.72
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.19
Polar Surface Area: 137 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 73.2±5.0 dyne/cm
Molar Volume: 230.0±5.0 cm3

Click to predict properties on the Chemicalize site


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