ChemSpider 2D Image | MFCD00797670 | C29H36O4

MFCD00797670

  • Molecular FormulaC29H36O4
  • Average mass448.594 Da
  • Monoisotopic mass448.261353 Da
  • ChemSpider ID21467333
  • Double-bond stereo - Double-bond stereo


More details:






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

(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatétraénoate de 2-oxo-2H-chromén-7-yle [French] [ACD/IUPAC Name]
161180-11-6 [RN]
200-578-6 [EINECS]
2-Oxo-2H-chromen-7-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate [ACD/IUPAC Name]
2-Oxo-2H-chromen-7-yl-(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
5,8,11,14-Eicosatetraenoic acid, 2-oxo-2H-1-benzopyran-7-yl ester, (5Z,8Z,11Z,14Z)- [ACD/Index Name]
5Z,8Z,11Z,14Z-Eicosatetraenoic acid 2-oxo-2H-1-benzopyran-7-yl ester
7-HC-ARACHIDONATE
7-hydroxycoumarinyl Arachidonate
MFCD00797670
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 584.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 289.4±28.5 °C
Index of Refraction: 1.545
Molar Refractivity: 134.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 8.02
ACD/LogD (pH 5.5): 7.67
ACD/BCF (pH 5.5): 400340.38
ACD/KOC (pH 5.5): 356280.19
ACD/LogD (pH 7.4): 7.67
ACD/BCF (pH 7.4): 400340.38
ACD/KOC (pH 7.4): 356280.19
Polar Surface Area: 53 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 426.3±3.0 cm3

Click to predict properties on the Chemicalize site






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