ChemSpider 2D Image | 3-[(1-Hydroxyhexyl)oxy]-2-[(1-hydroxypentadecyl)oxy]propyl 2-[(1-hydroxypentadecyl)oxy]-3-[(1-hydroxytridecyl)oxy]propyl 2-hydroxy-1,3-propanediyl bis(phosphate) | C58H118O17P2

3-[(1-Hydroxyhexyl)oxy]-2-[(1-hydroxypentadecyl)oxy]propyl 2-[(1-hydroxypentadecyl)oxy]-3-[(1-hydroxytridecyl)oxy]propyl 2-hydroxy-1,3-propanediyl bis(phosphate)

  • Molecular FormulaC58H118O17P2
  • Average mass1149.496 Da
  • Monoisotopic mass1148.785522 Da
  • ChemSpider ID21233306

  • Charge - Charge

More details:

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

3-[(1-Hydroxyhexyl)oxy]-2-[(1-hydroxypentadecyl)oxy]propyl 2-[(1-hydroxypentadecyl)oxy]-3-[(1-hydroxytridecyl)oxy]propyl 2-hydroxy-1,3-propanediyl bis(phosphate) [ACD/IUPAC Name]
3-[(1-Hydroxyhexyl)oxy]-2-[(1-hydroxypentadecyl)oxy]propyl-2-[(1-hydroxypentadecyl)oxy]-3-[(1-hydroxytridecyl)oxy]propyl-2-hydroxy-1,3-propandiylbis(phosphat) [German] [ACD/IUPAC Name]
Bis(phosphate) de 3-[(1-hydroxyhexyl)oxy]-2-[(1-hydroxypentadécyl)oxy]propyle et de 2-[(1-hydroxypentadécyl)oxy]-3-[(1-hydroxytridécyl)oxy]propyle et de 2-hydroxy-1,3-propanediyle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 983.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 162.5±6.0 kJ/mol
Flash Point: 548.6±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 17
#H bond donors: 7
#Freely Rotating Bonds: 63
#Rule of 5 Violations: 4
ACD/LogP: 19.65
ACD/LogD (pH 5.5): 11.62
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 444787.75
ACD/LogD (pH 7.4): 11.62
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 444239.69
Polar Surface Area: 275 Å2
Polarizability:
Surface Tension:
Molar Volume:

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