ChemSpider 2D Image | 3-hydroxy-3-(methylphosphono)isobenzofuranone | C9H9O6P

3-hydroxy-3-(methylphosphono)isobenzofuranone

  • Molecular FormulaC9H9O6P
  • Average mass244.138 Da
  • Monoisotopic mass244.013672 Da
  • ChemSpider ID25936647

More details:

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

3-hydroxy-3-(methylphosphono)isobenzofuranone
Hydrogéno(1-hydroxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)phosphonate de méthyle [French] [ACD/IUPAC Name]
Methyl hydrogen (1-hydroxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)phosphonate [ACD/IUPAC Name]
Methyl-hydrogen(1-hydroxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-(1,3-dihydro-1-hydroxy-3-oxo-1-isobenzofuranyl)-, monomethyl ester [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 529.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 274.0±32.9 °C
Index of Refraction: 1.604
Molar Refractivity: 52.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.42
ACD/LogD (pH 5.5): -3.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 71.6±5.0 dyne/cm
Molar Volume: 151.3±5.0 cm3

Click to predict properties on the Chemicalize site


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