ChemSpider 2D Image | (18R)-24-Amino-21-hydroxy-21-oxido-15-oxo-16,20,22-trioxa-21lambda~5~-phosphatetracosan-18-yl (13Z)-13-docosenoate | C42H82NO8P

(18R)-24-Amino-21-hydroxy-21-oxido-15-oxo-16,20,22-trioxa-21λ5-phosphatetracosan-18-yl (13Z)-13-docosenoate

  • Molecular FormulaC42H82NO8P
  • Average mass760.076 Da
  • Monoisotopic mass759.577820 Da
  • ChemSpider ID24768410

  • 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

(13Z)-13-Docosénoate de (18R)-24-amino-21-hydroxy-15-oxo-21-oxydo-16,20,22-trioxa-21λ5-phosphatétracosan-18-yle [French] [ACD/IUPAC Name]
(18R)-24-Amino-21-hydroxy-21-oxido-15-oxo-16,20,22-trioxa-21λ5-phosphatetracosan-18-yl (13Z)-13-docosenoate [ACD/IUPAC Name]
(18R)-24-Amino-21-hydroxy-21-oxido-15-oxo-16,20,22-trioxa-21λ5-phosphatetracosan-18-yl-(13Z)-13-docosenoat [German] [ACD/IUPAC Name]
13-Docosenoic acid, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[(1-oxopentadecyl)oxy]methyl]ethyl ester, (13Z)- [ACD/Index Name]
(2-AMINOETHOXY)[(2R)-2-[(13Z)-DOCOS-13-ENOYLOXY]-3-(PENTADECANOYLOXY)PROPOXY]PHOSPHINIC ACID
1-Pentadecanoyl-2-erucoyl-sn-glycero-3-phosphoethanolamine
2-AMINOETHOXY((2R)-2-[(13Z)-DOCOS-13-ENOYLOXY]-3-(PENTADECANOYLOXY)PROPOXY)PHOSPHINIC ACID
2-aminoethoxy(2R)-2-[(13Z)-docos-13-enoyloxy]-3-(pentadecanoyloxy)propoxyphosphinic acid
GPEtn(15:0/22:1)
GPEtn(15:0/22:1n9)
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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: 768.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 121.7±6.0 kJ/mol
Flash Point: 418.6±35.7 °C
Index of Refraction: 1.479
Molar Refractivity: 215.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 2
ACD/LogP: 15.84
ACD/LogD (pH 5.5): 11.04
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1751469.13
ACD/LogD (pH 7.4): 10.95
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1411045.13
Polar Surface Area: 144 Å2
Polarizability: 85.5±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 760.8±3.0 cm3

Click to predict properties on the Chemicalize site


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