ChemSpider 2D Image | Diethyl [(7-methyl-4,5,6,7-tetrahydro[1,2]oxazolo[3,4-c]pyridin-7-yl)methyl]phosphonate | C12H21N2O4P

Diethyl [(7-methyl-4,5,6,7-tetrahydro[1,2]oxazolo[3,4-c]pyridin-7-yl)methyl]phosphonate

  • Molecular FormulaC12H21N2O4P
  • Average mass288.280 Da
  • Monoisotopic mass288.123901 Da
  • ChemSpider ID83968182

More details:

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

[(7-Méthyl-4,5,6,7-tétrahydro[1,2]oxazolo[3,4-c]pyridin-7-yl)méthyl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(7-methyl-4,5,6,7-tetrahydro[1,2]oxazolo[3,4-c]pyridin-7-yl)methyl]phosphonate [ACD/IUPAC Name]
Diethyl-[(7-methyl-4,5,6,7-tetrahydro[1,2]oxazolo[3,4-c]pyridin-7-yl)methyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[(4,5,6,7-tetrahydro-7-methylisoxazolo[3,4-c]pyridin-7-yl)methyl]-, diethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 417.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 206.1±25.9 °C
Index of Refraction: 1.473
Molar Refractivity: 70.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.17
ACD/LogD (pH 7.4): 0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.61
Polar Surface Area: 83 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 250.7±3.0 cm3

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