ChemSpider 2D Image | 9-(Heptadecanoyloxy)-6-hydroxy-6-oxido-5,7-dioxa-2-aza-6lambda~5~-phosphadecan-10-yl heptadecanoate | C40H80NO8P

9-(Heptadecanoyloxy)-6-hydroxy-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl heptadecanoate

  • Molecular FormulaC40H80NO8P
  • Average mass734.039 Da
  • Monoisotopic mass733.562134 Da
  • ChemSpider ID7825992

More details:

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

9-(Heptadecanoyloxy)-6-hydroxy-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl heptadecanoate [ACD/IUPAC Name]
9-(Heptadecanoyloxy)-6-hydroxy-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl-heptadecanoat [German] [ACD/IUPAC Name]
Heptadécanoate de 9-(heptadecanoyloxy)-6-hydroxy-6-oxydo-5,7-dioxa-2-aza-6λ5-phosphadécan-10-yle [French] [ACD/IUPAC Name]
Heptadecanoic acid, 1-[[[hydroxy[2-(methylamino)ethoxy]phosphinyl]oxy]methyl]-1,2-ethanediyl ester [ACD/Index Name]
1,2-diheptadecanoyl-sn-glycero-3-phospho-N-methylethanolamine
GPEtnNMe(17:0/17:0)[U]

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

LMGP02010349 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 743.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 117.9±6.0 kJ/mol
Flash Point: 403.2±35.7 °C
Index of Refraction: 1.470
Molar Refractivity: 206.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 15.00
ACD/LogD (pH 5.5): 11.09
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1860055.88
ACD/LogD (pH 7.4): 11.08
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1818307.75
Polar Surface Area: 130 Å2
Polarizability: 81.8±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 739.3±3.0 cm3

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