ChemSpider 2D Image | [(1E)-2-Methyl-1,3-butadien-1-yl]phosphonic acid | C5H9O3P

[(1E)-2-Methyl-1,3-butadien-1-yl]phosphonic acid

  • Molecular FormulaC5H9O3P
  • Average mass148.097 Da
  • Monoisotopic mass148.028931 Da
  • ChemSpider ID35763849

  • Double-bond stereo - Double-bond stereo

More details:

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

[(1E)-2-Methyl-1,3-butadien-1-yl]phosphonic acid [ACD/IUPAC Name]
[(1E)-2-Methyl-1,3-butadien-1-yl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [(1E)-2-méthyl-1,3-butadién-1-yl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [(1E)-2-methyl-1,3-butadien-1-yl]- [ACD/Index Name]
PHOSPHONIC ACID, (2-METHYL-1,3-BUTADIENYL)-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 308.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.4±6.0 kJ/mol
Flash Point: 140.3±23.2 °C
Index of Refraction: 1.498
Molar Refractivity: 34.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): -3.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 13.8±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 118.7±3.0 cm3

Click to predict properties on the Chemicalize site


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