ChemSpider 2D Image | Ethyl 2-[1-(diisopropoxyphosphoryl)ethyl]-3-hydroxy-3-butenoate | C14H27O6P

Ethyl 2-[1-(diisopropoxyphosphoryl)ethyl]-3-hydroxy-3-butenoate

  • Molecular FormulaC14H27O6P
  • Average mass322.334 Da
  • Monoisotopic mass322.154510 Da
  • ChemSpider ID95769544

More details:

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

2-[1-(Diisopropoxyphosphoryl)éthyl]-3-hydroxy-3-buténoate d'éthyle [French] [ACD/IUPAC Name]
3-Butenoic acid, 2-[1-[bis(1-methylethoxy)phosphinyl]ethyl]-3-hydroxy-, ethyl ester [ACD/Index Name]
Ethyl 2-[1-(diisopropoxyphosphoryl)ethyl]-3-hydroxy-3-butenoate [ACD/IUPAC Name]
Ethyl-2-[1-(diisopropoxyphosphoryl)ethyl]-3-hydroxy-3-butenoat [German] [ACD/IUPAC 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: 420.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.9±6.0 kJ/mol
Flash Point: 208.2±28.7 °C
Index of Refraction: 1.457
Molar Refractivity: 80.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 35.30
ACD/KOC (pH 5.5): 446.20
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.88
ACD/KOC (pH 7.4): 440.91
Polar Surface Area: 92 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 35.4±3.0 dyne/cm
Molar Volume: 293.9±3.0 cm3

Click to predict properties on the Chemicalize site


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