ChemSpider 2D Image | Diethyl [2-(4,9-dioxo-4,9-dihydro-1H-naphtho[2,3-d][1,2,3]triazol-1-yl)ethyl]phosphonate | C16H18N3O5P

Diethyl [2-(4,9-dioxo-4,9-dihydro-1H-naphtho[2,3-d][1,2,3]triazol-1-yl)ethyl]phosphonate

  • Molecular FormulaC16H18N3O5P
  • Average mass363.305 Da
  • Monoisotopic mass363.098419 Da
  • ChemSpider ID90646446

More details:

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

[2-(4,9-Dioxo-4,9-dihydro-1H-naphto[2,3-d][1,2,3]triazol-1-yl)éthyl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [2-(4,9-dioxo-4,9-dihydro-1H-naphtho[2,3-d][1,2,3]triazol-1-yl)ethyl]phosphonate [ACD/IUPAC Name]
Diethyl-[2-(4,9-dioxo-4,9-dihydro-1H-naphtho[2,3-d][1,2,3]triazol-1-yl)ethyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[2-(4,9-dihydro-4,9-dioxo-1H-naphtho[2,3-d]-1,2,3-triazol-1-yl)ethyl]-, diethyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 566.0±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.0±3.0 kJ/mol
Flash Point: 296.1±30.7 °C
Index of Refraction: 1.649
Molar Refractivity: 90.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.21
ACD/KOC (pH 5.5): 157.02
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.21
ACD/KOC (pH 7.4): 157.02
Polar Surface Area: 110 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 61.0±7.0 dyne/cm
Molar Volume: 248.3±7.0 cm3

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