ChemSpider 2D Image | 2-Ammonio-8-(octanoyloxy)-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctadecan-1-oate 5-oxide | C22H41NO10P

2-Ammonio-8-(octanoyloxy)-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctadecan-1-oate 5-oxide

  • Molecular FormulaC22H41NO10P
  • Average mass510.536 Da
  • Monoisotopic mass510.247345 Da
  • ChemSpider ID95670777
  • Charge - Charge


More details:






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

2-Ammonio-8-(octanoyloxy)-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctadecan-1-oat-5-oxid [German] [ACD/IUPAC Name]
2-Ammonio-8-(octanoyloxy)-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctadecan-1-oate 5-oxide [ACD/IUPAC Name]
5-Oxyde de 2-ammonio-8-(octanoyloxy)-11-oxo-5-oxydo-4,6,10-trioxa-5-phosphaoctadécan-1-oate [French] [ACD/IUPAC Name]
Octanoic acid, 1-[[[(2-amino-2-carboxyethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, kis(inner salt), ion(0-) [ACD/Index Name]

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

Density:
Boiling Point: 639.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 103.1±6.0 kJ/mol
Flash Point: 340.8±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 3
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.53
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.20
Polar Surface Area: 189 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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