Found 24 results

Search term: MF = 'C_{37}H_{67}O_{9}P'
ChemSpider 2D Image | (2R)-2-[(14-Methylpentadecanoyl)oxy]-3-(phosphonooxy)propyl (10E,12E,15E)-9-hydroxy-10,12,15-octadecatrienoate | C37H67O9P

(2R)-2-[(14-Methylpentadecanoyl)oxy]-3-(phosphonooxy)propyl (10E,12E,15E)-9-hydroxy-10,12,15-octadecatrienoate

  • Molecular FormulaC37H67O9P
  • Average mass686.896 Da
  • Monoisotopic mass686.452271 Da
  • ChemSpider ID117222966

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(10E,12E,15E)-9-Hydroxy-10,12,15-octadécatriénoate de (2R)-2-[(14-méthylpentadecanoyl)oxy]-3-(phosphonooxy)propyle [French] [ACD/IUPAC Name]
(2R)-2-[(14-Methylpentadecanoyl)oxy]-3-(phosphonooxy)propyl (10E,12E,15E)-9-hydroxy-10,12,15-octadecatrienoate [ACD/IUPAC Name]
(2R)-2-[(14-Methylpentadecanoyl)oxy]-3-(phosphonooxy)propyl-(10E,12E,15E)-9-hydroxy-10,12,15-octadecatrienoat [German] [ACD/IUPAC Name]
10,12,15-Octadecatrienoic acid, 9-hydroxy-, (2R)-2-[(14-methyl-1-oxopentadecyl)oxy]-3-(phosphonooxy)propyl ester, (10E,12E,15E)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 753.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 125.3±6.0 kJ/mol
Flash Point: 409.8±35.7 °C
Index of Refraction: 1.496
Molar Refractivity: 190.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 2
ACD/LogP: 11.14
ACD/LogD (pH 5.5): 5.79
ACD/BCF (pH 5.5): 2304.69
ACD/KOC (pH 5.5): 980.54
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 271.17
ACD/KOC (pH 7.4): 115.37
Polar Surface Area: 149 Å2
Polarizability: 75.4±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 651.3±3.0 cm3

Click to predict properties on the Chemicalize site


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