ChemSpider 2D Image | (9R)-6-Hydroxy-2-methyl-9-[(9E)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6lambda~5~-phosphadecan-10-yl (9E)-9-octadecenoate | C43H82NO8P

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

  • Molecular FormulaC43H82NO8P
  • Average mass772.087 Da
  • Monoisotopic mass771.577820 Da
  • ChemSpider ID7825974

  • 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

(9E)-9-Octadécénoate de (9R)-6-hydroxy-2-méthyl-9-[(9E)-9-octadecenoyloxy]-6-oxydo-5,7-dioxa-2-aza-6λ5-phosphadécan-10-yle [French] [ACD/IUPAC Name]
(9R)-6-Hydroxy-2-methyl-9-[(9E)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl (9E)-9-octadecenoate [ACD/IUPAC Name]
(9R)-6-Hydroxy-2-methyl-9-[(9E)-9-octadecenoyloxy]-6-oxido-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl-(9E)-9-octadecenoat [German] [ACD/IUPAC Name]
9-Octadecenoic acid, (1R)-1-[[[[2-(dimethylamino)ethoxy]hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, (9E,9'E)- [ACD/Index Name]
[(2R)-2,3-bis(octadec-9-enoyloxy)propoxy][2-(dimethylamino)ethoxy]phosphinic acid
1,2-di-(9E-octadecenoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine
9-Octadecenoic acid, 1-(3-hydroxy-7-methyl-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester, P-oxide, [R-(E,E)]
9-Octadecenoic acid, 1-(3-hydroxy-7-methyl-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester, [R-(E,E)]-
GPEtnNMe2(18:1(9E)/18:1(9E))
PE-NMe2(18:1(9E)/18:1(9E))
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

LMGP02010329 [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: 761.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 120.7±6.0 kJ/mol
Flash Point: 414.6±35.7 °C
Index of Refraction: 1.481
Molar Refractivity: 220.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 15.52
ACD/LogD (pH 5.5): 10.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1633709.50
ACD/LogD (pH 7.4): 10.96
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1525218.13
Polar Surface Area: 121 Å2
Polarizability: 87.4±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 774.5±3.0 cm3

Click to predict properties on the Chemicalize site


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