ChemSpider 2D Image | 3-(1H-Benzotriazol-1-yl)-1-(3-methoxyphenyl)-1-propanone | C16H15N3O2

3-(1H-Benzotriazol-1-yl)-1-(3-methoxyphenyl)-1-propanone

  • Molecular FormulaC16H15N3O2
  • Average mass281.309 Da
  • Monoisotopic mass281.116425 Da
  • ChemSpider ID21126019

More details:

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

1-Propanone, 3-(1H-1,2,3-benzotriazol-1-yl)-1-(3-methoxyphenyl)- [ACD/Index Name]
3-(1H-Benzotriazol-1-yl)-1-(3-methoxyphenyl)-1-propanon [German] [ACD/IUPAC Name]
3-(1H-Benzotriazol-1-yl)-1-(3-methoxyphenyl)-1-propanone [ACD/IUPAC Name]
3-(1H-Benzotriazol-1-yl)-1-(3-méthoxyphényl)-1-propanone [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 487.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 248.9±23.2 °C
Index of Refraction: 1.627
Molar Refractivity: 80.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 46.55
ACD/KOC (pH 5.5): 543.91
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 46.56
ACD/KOC (pH 7.4): 543.94
Polar Surface Area: 57 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 227.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement