ChemSpider 2D Image | 4-Hydroxy-4-oxido-10-oxo-3,5,9-trioxa-4lambda~5~-phosphapentacosan-7-yl (9E)-9-octadecenoate | C39H75O8P

4-Hydroxy-4-oxido-10-oxo-3,5,9-trioxa-4λ5-phosphapentacosan-7-yl (9E)-9-octadecenoate

  • Molecular FormulaC39H75O8P
  • Average mass702.982 Da
  • Monoisotopic mass702.519958 Da
  • ChemSpider ID111133603

  • Double-bond stereo - Double-bond stereo

More details:

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

(9E)-9-Octadécénoate de 4-hydroxy-10-oxo-4-oxydo-3,5,9-trioxa-4λ5-phosphapentacosan-7-yle [French] [ACD/IUPAC Name]
4-Hydroxy-4-oxido-10-oxo-3,5,9-trioxa-4λ5-phosphapentacosan-7-yl (9E)-9-octadecenoate [ACD/IUPAC Name]
4-Hydroxy-4-oxido-10-oxo-3,5,9-trioxa-4λ5-phosphapentacosan-7-yl-(9E)-9-octadecenoat [German] [ACD/IUPAC Name]
9-Octadecenoic acid, 2-[(ethoxyhydroxyphosphinyl)oxy]-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester, (9E)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 718.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 114.3±6.0 kJ/mol
Flash Point: 388.4±35.7 °C
Index of Refraction: 1.472
Molar Refractivity: 198.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 2
ACD/LogP: 15.35
ACD/LogD (pH 5.5): 10.22
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 238444.88
ACD/LogD (pH 7.4): 10.13
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 196166.77
Polar Surface Area: 118 Å2
Polarizability: 78.6±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 707.6±3.0 cm3

Click to predict properties on the Chemicalize site


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