ChemSpider 2D Image | N-[(9Z)-9-Hexadecenoyl]phenylalanine | C25H39NO3

N-[(9Z)-9-Hexadecenoyl]phenylalanine

  • Molecular FormulaC25H39NO3
  • Average mass401.582 Da
  • Monoisotopic mass401.292999 Da
  • ChemSpider ID67972692

  • Double-bond stereo - Double-bond stereo

More details:

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

N-[(9Z)-9-Hexadecenoyl]phenylalanin [German] [ACD/IUPAC Name]
N-[(9Z)-9-Hexadecenoyl]phenylalanine [ACD/IUPAC Name]
N-[(9Z)-9-Hexadecenoyl]phénylalanine [French] [ACD/IUPAC Name]
Phenylalanine, N-[(9Z)-1-oxo-9-hexadecen-1-yl]- [ACD/Index Name]
2-[[(Z)-hexadec-9-enoyl]amino]-3-phenylpropanoic acid
Compound NP-020177

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

Density: 1.0±0.1 g/cm3
Boiling Point: 590.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 311.2±30.1 °C
Index of Refraction: 1.515
Molar Refractivity: 119.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 7.70
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 767.37
ACD/KOC (pH 5.5): 945.73
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 32.07
ACD/KOC (pH 7.4): 39.53
Polar Surface Area: 66 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 397.4±3.0 cm3

Click to predict properties on the Chemicalize site


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