ChemSpider 2D Image | {4-[(1-Benzyl-5-butyl-1H-1,2,3-triazol-4-yl)sulfonyl]phenyl}methanol | C20H23N3O3S

{4-[(1-Benzyl-5-butyl-1H-1,2,3-triazol-4-yl)sulfonyl]phenyl}methanol

  • Molecular FormulaC20H23N3O3S
  • Average mass385.480 Da
  • Monoisotopic mass385.146027 Da
  • ChemSpider ID30658772

More details:

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

{4-[(1-Benzyl-5-butyl-1H-1,2,3-triazol-4-yl)sulfonyl]phenyl}methanol [German] [ACD/IUPAC Name]
{4-[(1-Benzyl-5-butyl-1H-1,2,3-triazol-4-yl)sulfonyl]phenyl}methanol [ACD/IUPAC Name]
{4-[(1-Benzyl-5-butyl-1H-1,2,3-triazol-4-yl)sulfonyl]phényl}méthanol [French] [ACD/IUPAC Name]
Benzenemethanol, 4-[[5-butyl-1-(phenylmethyl)-1H-1,2,3-triazol-4-yl]sulfonyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 631.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 335.6±34.3 °C
Index of Refraction: 1.621
Molar Refractivity: 107.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 85.82
ACD/KOC (pH 5.5): 842.67
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 85.82
ACD/KOC (pH 7.4): 842.67
Polar Surface Area: 93 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 305.8±7.0 cm3

Click to predict properties on the Chemicalize site


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