ChemSpider 2D Image | 3-{[Bis(2-hydroxyethyl)phosphoryl]oxy}-1,2,3-benzotriazin-4(3H)-one | C11H14N3O5P

3-{[Bis(2-hydroxyethyl)phosphoryl]oxy}-1,2,3-benzotriazin-4(3H)-one

  • Molecular FormulaC11H14N3O5P
  • Average mass299.220 Da
  • Monoisotopic mass299.067108 Da
  • ChemSpider ID65793058

More details:

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

1,2,3-Benzotriazin-4(3H)-one, 3-[[bis(2-hydroxyethyl)phosphinyl]oxy]- [ACD/Index Name]
3-{[Bis(2-hydroxyethyl)phosphoryl]oxy}-1,2,3-benzotriazin-4(3H)-on [German] [ACD/IUPAC Name]
3-{[Bis(2-hydroxyethyl)phosphoryl]oxy}-1,2,3-benzotriazin-4(3H)-one [ACD/IUPAC Name]
3-{[Bis(2-hydroxyéthyl)phosphoryl]oxy}-1,2,3-benzotriazin-4(3H)-one [French] [ACD/IUPAC Name]
3-(diethoxyphosphoryloxy)-1,2,3-benzotrazin-4(3h)-one

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

Density: 1.6±0.1 g/cm3
Boiling Point: 500.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 256.3±32.9 °C
Index of Refraction: 1.661
Molar Refractivity: 69.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.84
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.38
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.38
Polar Surface Area: 122 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 75.5±7.0 dyne/cm
Molar Volume: 189.0±7.0 cm3

Click to predict properties on the Chemicalize site


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