ChemSpider 2D Image | 31-Amino-28-hydroxy-28-oxido-22-oxo-23,27,29-trioxa-28lambda~5~-phosphahentriacontan-25-yl tricosanoate | C50H100NO8P

31-Amino-28-hydroxy-28-oxido-22-oxo-23,27,29-trioxa-28λ5-phosphahentriacontan-25-yl tricosanoate

  • Molecular FormulaC50H100NO8P
  • Average mass874.305 Da
  • Monoisotopic mass873.718628 Da
  • ChemSpider ID7825734

More details:

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

31-Amino-28-hydroxy-28-oxido-22-oxo-23,27,29-trioxa-28λ5-phosphahentriacontan-25-yl tricosanoate [ACD/IUPAC Name]
31-Amino-28-hydroxy-28-oxido-22-oxo-23,27,29-trioxa-28λ5-phosphahentriacontan-25-yl-tricosanoat [German] [ACD/IUPAC Name]
Tricosanoate de 31-amino-28-hydroxy-22-oxo-28-oxydo-23,27,29-trioxa-28λ5-phosphahéntriacontan-25-yle [French] [ACD/IUPAC Name]
Tricosanoic acid, 2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[(1-oxodocosyl)oxy]methyl]ethyl ester [ACD/Index Name]
1-docosanoyl-2-tricosanoyl-sn-glycero-3-phosphoethanolamine
GPEtn(22:0/23:0)[U]
Tricosanoic acid, 1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-2-[(1-oxodocosyl)oxy]ethyl ester

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

LMGP02010080 [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: 838.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 132.2±6.0 kJ/mol
Flash Point: 460.6±37.1 °C
Index of Refraction: 1.474
Molar Refractivity: 252.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 52
#Rule of 5 Violations: 2
ACD/LogP: 20.61
ACD/LogD (pH 5.5): 15.21
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.12
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 144 Å2
Polarizability: 100.2±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 899.3±3.0 cm3

Click to predict properties on the Chemicalize site


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