Found 8 results

Search term: MF = 'C_{41}H_{65}O_{8}P'
ChemSpider 2D Image | (2R)-2-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-3-(phosphonooxy)propyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate | C41H65O8P

(2R)-2-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-3-(phosphonooxy)propyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate

  • Molecular FormulaC41H65O8P
  • Average mass716.924 Da
  • Monoisotopic mass716.441711 Da
  • ChemSpider ID74876947

  • 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

(2R)-2-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-3-(phosphonooxy)propyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate [ACD/IUPAC Name]
(2R)-2-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-3-(phosphonooxy)propyl-(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoat [German] [ACD/IUPAC Name]
(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapentaénoate de (2R)-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]-3-(phosphonooxy)propyle [French] [ACD/IUPAC Name]
5,8,11,14,17-Eicosapentaenoic acid, (2R)-2-[[(9Z,12Z,15Z)-1-oxo-9,12,15-octadecatrien-1-yl]oxy]-3-(phosphonooxy)propyl ester, (5Z,8Z,11Z,14Z,17Z)- [ACD/Index Name]
(2R)-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxyphosphonic acid
[(2R)-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]phosphonic acid
1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-glycero-3-phosphate
PA(18:3_20:5)
PA(38:8)

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 759.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 120.3±6.0 kJ/mol
Flash Point: 412.9±35.7 °C
Index of Refraction: 1.516
Molar Refractivity: 207.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 2
ACD/LogP: 12.19
ACD/LogD (pH 5.5): 5.70
ACD/BCF (pH 5.5): 1948.73
ACD/KOC (pH 5.5): 869.55
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 229.30
ACD/KOC (pH 7.4): 102.32
Polar Surface Area: 129 Å2
Polarizability: 82.3±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 687.1±3.0 cm3

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