ChemSpider 2D Image | Ethyl hydrogen (2,6-dimethyl-3,5-dinitro-4-pyridinyl)phosphonate | C9H12N3O7P

Ethyl hydrogen (2,6-dimethyl-3,5-dinitro-4-pyridinyl)phosphonate

  • Molecular FormulaC9H12N3O7P
  • Average mass305.181 Da
  • Monoisotopic mass305.041290 Da
  • ChemSpider ID62802646

More details:






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

Ethyl hydrogen (2,6-dimethyl-3,5-dinitro-4-pyridinyl)phosphonate [ACD/IUPAC Name]
Ethyl-hydrogen(2,6-dimethyl-3,5-dinitro-4-pyridinyl)phosphonat [German] [ACD/IUPAC Name]
Hydrogéno(2,6-diméthyl-3,5-dinitro-4-pyridinyl)phosphonate d'éthyle [French] [ACD/IUPAC Name]
Phosphonic acid, P-(2,6-dimethyl-3,5-dinitro-4-pyridinyl)-, monoethyl ester [ACD/Index Name]
89257-82-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 475.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 241.3±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 65.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.11
ACD/LogD (pH 5.5): -3.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 161 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 69.0±5.0 dyne/cm
Molar Volume: 200.8±5.0 cm3

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