ChemSpider 2D Image | Methyl 3-hydroxy-3-methyl-5-(phosphonooxy)pentanoate | C7H15O7P

Methyl 3-hydroxy-3-methyl-5-(phosphonooxy)pentanoate

  • Molecular FormulaC7H15O7P
  • Average mass242.164 Da
  • Monoisotopic mass242.055542 Da
  • ChemSpider ID28553715

More details:






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

3-Hydroxy-3-méthyl-5-(phosphonooxy)pentanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-hydroxy-3-methyl-5-(phosphonooxy)pentanoate [ACD/IUPAC Name]
Methyl-3-hydroxy-3-methyl-5-(phosphonooxy)pentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 3-hydroxy-3-methyl-5-(phosphonooxy)-, 1-methyl ester [ACD/Index Name]
675199-74-3 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 435.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 79.8±6.0 kJ/mol
Flash Point: 217.1±31.5 °C
Index of Refraction: 1.491
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -1.71
ACD/LogD (pH 5.5): -4.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 58.8±3.0 dyne/cm
Molar Volume: 170.6±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement