Found 16 results

Search term: MF = 'C_{51}H_{100}NO_{8}P'
ChemSpider 2D Image | 6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6lambda~5~-phosphatritriacontan-9-yl (13Z)-13-docosenoate | C51H100NO8P

6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6λ5-phosphatritriacontan-9-yl (13Z)-13-docosenoate

  • Molecular FormulaC51H100NO8P
  • Average mass886.315 Da
  • Monoisotopic mass885.718628 Da
  • ChemSpider ID74851218

  • Double-bond stereo - Double-bond stereo

More details:

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

(13Z)-13-Docosénoate de 6-hydroxy-2-méthyl-12-oxo-6-oxydo-5,7,11-trioxa-2-aza-6λ5-phosphatritriacontan-9-yle [French] [ACD/IUPAC Name]
13-Docosenoic acid, 2-[[[2-(dimethylamino)ethoxy]hydroxyphosphinyl]oxy]-1-[[(1-oxodocosyl)oxy]methyl]ethyl ester, (13Z)- [ACD/Index Name]
6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6λ5-phosphatritriacontan-9-yl (13Z)-13-docosenoate [ACD/IUPAC Name]
6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6λ5-phosphatritriacontan-9-yl-(13Z)-13-docosenoat [German] [ACD/IUPAC Name]
[2-(dimethylamino)ethoxy]({2-[(13Z)-docos-13-enoyloxy]-3-(docosanoyloxy)propoxy})phosphinic acid
2-(dimethylamino)ethoxy(2-[(13Z)-docos-13-enoyloxy]-3-(docosanoyloxy)propoxy)phosphinic acid
PE-NMe2(22:0/22:1(13Z))

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: 832.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 131.3±6.0 kJ/mol
Flash Point: 457.0±37.1 °C
Index of Refraction: 1.476
Molar Refractivity: 257.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 51
#Rule of 5 Violations: 2
ACD/LogP: 20.29
ACD/LogD (pH 5.5): 14.87
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.84
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 121 Å2
Polarizability: 102.1±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 913.0±3.0 cm3

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