ChemSpider 2D Image | N-Arachidonoyl-L-Alanine | C23H37NO3

N-Arachidonoyl-L-Alanine

  • Molecular FormulaC23H37NO3
  • Average mass375.545 Da
  • Monoisotopic mass375.277344 Da
  • ChemSpider ID23283785
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

401941-73-9 [RN]
L-Alanine, N-[(5Z,8Z,11Z,14Z)-1-oxo-5,8,11,14-eicosatetraen-1-yl]- [ACD/Index Name]
N-[(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoyl]-L-alanin [German] [ACD/IUPAC Name]
N-[(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoyl]-L-alanine [ACD/IUPAC Name]
N-[(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoyl]-L-alanine [French] [ACD/IUPAC Name]
N-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]-L-alanine
N-Arachidonoyl-L-Alanine
(2S)-2-[[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]amino]propanoic acid
(S)-2-((5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenamido)propanoic acid
[401941-73-9]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 566.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 92.9±6.0 kJ/mol
Flash Point: 296.3±30.1 °C
Index of Refraction: 1.506
Molar Refractivity: 114.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 6.22
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 85.29
ACD/KOC (pH 5.5): 204.80
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 3.22
ACD/KOC (pH 7.4): 7.73
Polar Surface Area: 66 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 383.6±3.0 cm3

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