ChemSpider 2D Image | (2R)-2-(4-Carboxybutoxy)-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate | C29H60NO8P

(2R)-2-(4-Carboxybutoxy)-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC29H60NO8P
  • Average mass581.762 Da
  • Monoisotopic mass581.405640 Da
  • ChemSpider ID64854641

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-(4-Carboxybutoxy)-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-(4-Carboxybutoxy)-3-(hexadecyloxy)propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
630112-41-3 [RN]
Ethanaminium, 2-[[[(2R)-2-(4-carboxybutoxy)-3-(hexadecyloxy)propoxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-2-(4-carboxybutoxy)-3-(hexadécyloxy)propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
[(2R)-2-(4-carboxybutoxy)-3-hexadecoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
1-Palmityl-2-(4-carboxybutyl)-SN-glycero-3-phosphocholine
Vb-201

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

SJ5A8151JO [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 1
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 59.16
ACD/KOC (pH 5.5): 620.57
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 27.55
ACD/KOC (pH 7.4): 288.96
Polar Surface Area: 124 Å2
Polarizability:
Surface Tension:
Molar Volume:

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