ChemSpider 2D Image | Methyl 3-[(2-methyl-2-propanyl)(phenylethynyl)phosphoryl]propanoate | C16H21O3P

Methyl 3-[(2-methyl-2-propanyl)(phenylethynyl)phosphoryl]propanoate

  • Molecular FormulaC16H21O3P
  • Average mass292.310 Da
  • Monoisotopic mass292.122833 Da
  • ChemSpider ID74019218

More details:

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

3-[(2-Méthyl-2-propanyl)(phényléthynyl)phosphoryl]propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-[(2-methyl-2-propanyl)(phenylethynyl)phosphoryl]propanoate [ACD/IUPAC Name]
Methyl-3-[(2-methyl-2-propanyl)(phenylethinyl)phosphoryl]propanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3-[(1,1-dimethylethyl)(2-phenylethynyl)phosphinyl]-, methyl 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: 399.2±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 208.7±48.8 °C
Index of Refraction: 1.509
Molar Refractivity: 79.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 140.40
ACD/KOC (pH 5.5): 1198.64
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 140.40
ACD/KOC (pH 7.4): 1198.64
Polar Surface Area: 53 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 40.9±5.0 dyne/cm
Molar Volume: 266.8±5.0 cm3

Click to predict properties on the Chemicalize site


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