Found 1 result

Search term: 74855019 (Found by CSID)
ChemSpider 2D Image | (19R,31R)-22,25,28-Trihydroxy-22,28-dioxido-16,34-dioxo-17,21,23,27,29,33-hexaoxa-22lambda~5~,28lambda~5~-diphosphanonatetracontane-19,31-diyl (9Z,12Z,9'Z,12'Z)bis(-9,12-octadecadienoate) | C77H142O17P2

(19R,31R)-22,25,28-Trihydroxy-22,28-dioxido-16,34-dioxo-17,21,23,27,29,33-hexaoxa-22λ5,28λ5-diphosphanonatetracontane-19,31-diyl (9Z,12Z,9'Z,12'Z)bis(-9,12-octadecadienoate)

  • Molecular FormulaC77H142O17P2
  • Average mass1401.889 Da
  • Monoisotopic mass1400.972168 Da
  • ChemSpider ID74855019

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(19R,31R)-22,25,28-Trihydroxy-22,28-dioxido-16,34-dioxo-17,21,23,27,29,33-hexaoxa-22λ5,28λ5-diphosphanonatetracontan-19,31-diyl-(9Z,12Z,9'Z,12'Z)bis(-9,12-octadecadienoat) [German] [ACD/IUPAC Name]
(19R,31R)-22,25,28-Trihydroxy-22,28-dioxido-16,34-dioxo-17,21,23,27,29,33-hexaoxa-22λ5,28λ5-diphosphanonatetracontane-19,31-diyl (9Z,12Z,9'Z,12'Z)bis(-9,12-octadecadienoate) [ACD/IUPAC Name]
(9Z,12Z,9'Z,12'Z)Bis(-9,12-octadécadiénoate) de (19R,31R)-22,25,28-trihydroxy-16,34-dioxo-22,28-dioxydo-17,21,23,27,29,33-hexaoxa-22λ5,28λ5-diphosphanonatétracontane-19,31-diyle [French] [ACD/IUPAC Name]
9,12-Octadecadienoic acid, (2-hydroxy-1,3-propanediyl)bis[oxy(hydroxyphosphinyl)oxy(1R)-1-[[(1-oxohexadecyl)oxy]methyl]-2,1-ethanediyl] ester, (9Z,12Z,9'Z,12'Z)- [ACD/Index Name]
1',3'-Bis-[1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho]-sn-glycerol
CL(16:0/18:2(9Z,12Z)/16:0/18:2(9Z,12Z))
CL(16:016:018:2_18:2)
CL(68:4)

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: 1116.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 185.7±6.0 kJ/mol
Flash Point: 629.2±37.1 °C
Index of Refraction: 1.489
Molar Refractivity: 391.3±0.3 cm3
#H bond acceptors: 17
#H bond donors: 3
#Freely Rotating Bonds: 78
#Rule of 5 Violations: 3
ACD/LogP: 28.42
ACD/LogD (pH 5.5): 21.06
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 21.06
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 257 Å2
Polarizability: 155.1±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 1355.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement