ChemSpider 2D Image | 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-[(2E)-3-phenyl-2-propen-1-yl]proline | C19H25NO4

1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-[(2E)-3-phenyl-2-propen-1-yl]proline

  • Molecular FormulaC19H25NO4
  • Average mass331.406 Da
  • Monoisotopic mass331.178345 Da
  • ChemSpider ID72383207

  • Double-bond stereo - Double-bond stereo

More details:

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

1,2-Pyrrolidinedicarboxylic acid, 4-[(2E)-3-phenyl-2-propen-1-yl]-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-[(2E)-3-phenyl-2-propen-1-yl]prolin [German] [ACD/IUPAC Name]
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-[(2E)-3-phenyl-2-propen-1-yl]proline [ACD/IUPAC Name]
1-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-4-[(2E)-3-phényl-2-propén-1-yl]proline [French] [ACD/IUPAC Name]
MFCD06659442

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

Density: 1.2±0.1 g/cm3
Boiling Point: 484.5±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 246.8±26.8 °C
Index of Refraction: 1.565
Molar Refractivity: 93.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 9.77
ACD/KOC (pH 5.5): 65.50
ACD/LogD (pH 7.4): 0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.24
Polar Surface Area: 67 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 285.6±3.0 cm3

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