ChemSpider 2D Image | (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z)-1-hexadecen-1-yloxy]propyl tetracosanoate | C45H90NO7P

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z)-1-hexadecen-1-yloxy]propyl tetracosanoate

  • Molecular FormulaC45H90NO7P
  • Average mass788.172 Da
  • Monoisotopic mass787.645508 Da
  • ChemSpider ID24769181

  • 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)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z)-1-hexadecen-1-yloxy]propyl tetracosanoate [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z)-1-hexadecen-1-yloxy]propyl-tetracosanoat [German] [ACD/IUPAC Name]
Tétracosanoate de (2R)-3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z)-1-hexadécén-1-yloxy]propyle [French] [ACD/IUPAC Name]
Tetracosanoic acid, (2R)-3-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1Z)-1-hexadecen-1-yloxy]propyl ester [ACD/Index Name]
(2-AMINOETHOXY)[(2R)-2-[(1Z)-HEXADEC-1-EN-1-YLOXY]-3-(TETRACOSANOYLOXY)PROPOXY]PHOSPHINIC ACID
1-Lignoceroyl-2-(1-enyl-palmitoyl)-sn-glycero-3-phosphoethanolamine
2-AMINOETHOXY((2R)-2-[(1Z)-HEXADEC-1-EN-1-YLOXY]-3-(TETRACOSANOYLOXY)PROPOXY)PHOSPHINIC ACID
2-aminoethoxy(2R)-2-[(1Z)-hexadec-1-en-1-yloxy]-3-(tetracosanoyloxy)propoxyphosphinic acid
GPEtn(24:0/16:0)
GPEtn(40:0)
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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: 790.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 124.9±6.0 kJ/mol
Flash Point: 431.6±35.7 °C
Index of Refraction: 1.476
Molar Refractivity: 229.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 46
#Rule of 5 Violations: 2
ACD/LogP: 18.47
ACD/LogD (pH 5.5): 13.44
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.35
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 127 Å2
Polarizability: 91.0±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 813.2±3.0 cm3

Click to predict properties on the Chemicalize site


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