ChemSpider 2D Image | 6-Hydroxy-9-[(9Z)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6lambda~5~-phosphadecan-10-yl (9Z)-9-octadecenoate | C42H80NO8P

6-Hydroxy-9-[(9Z)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl (9Z)-9-octadecenoate

  • Molecular FormulaC42H80NO8P
  • Average mass758.060 Da
  • Monoisotopic mass757.562134 Da
  • ChemSpider ID7825977
  • Double-bond stereo - Double-bond stereo


More details:






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

(9Z)-9-Octadécénoate de 6-hydroxy-9-[(9Z)-9-octadecenoyloxy]-6-oxydo-5,7-dioxa-2-aza-6λ5-phosphadécan-10-yle [French] [ACD/IUPAC Name]
6-Hydroxy-9-[(9Z)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl (9Z)-9-octadecenoate [ACD/IUPAC Name]
6-Hydroxy-9-[(9Z)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl-(9Z)-9-octadecenoat [German] [ACD/IUPAC Name]
9-Octadecenoic acid, 1-[[[hydroxy[2-(methylamino)ethoxy]phosphinyl]oxy]methyl]-1,2-ethanediyl ester, (9Z,9'Z)- [ACD/Index Name]
1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phospho-N-methylethanolamine
96687-23-9 [RN]
9-Octadecenoic acid (Z)-, 1-(3-hydroxy-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester, P-oxide
9-Octadecenoic acid (Z)-, 1-(3-hydroxy-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester
GPEtnNMe(18:1(9Z)/18:1(9Z))[U]

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

LMGP02010333 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 760.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 120.5±6.0 kJ/mol
Flash Point: 413.6±35.7 °C
Index of Refraction: 1.480
Molar Refractivity: 215.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 15.03
ACD/LogD (pH 5.5): 10.64
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1058254.25
ACD/LogD (pH 7.4): 10.63
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1034502.19
Polar Surface Area: 130 Å2
Polarizability: 85.5±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 759.6±3.0 cm3

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