ChemSpider 2D Image | (2R)-3-(Hexanoyloxy)-2-hydroxypropyl phosphate | C9H17O7P

(2R)-3-(Hexanoyloxy)-2-hydroxypropyl phosphate

  • Molecular FormulaC9H17O7P
  • Average mass268.202 Da
  • Monoisotopic mass268.072296 Da
  • ChemSpider ID31150499

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-3-(Hexanoyloxy)-2-hydroxypropyl phosphate [ACD/IUPAC Name]
(2R)-3-(Hexanoyloxy)-2-hydroxypropylphosphat [German] [ACD/IUPAC Name]
Hexanoic acid, (2R)-2-hydroxy-3-(phosphonooxy)propyl ester, ion(2-) [ACD/Index Name]
Phosphate de (2R)-3-(hexanoyloxy)-2-hydroxypropyle [French] [ACD/IUPAC Name]
1-caproyl-sn-glycero-3-phosphate(2-)
1-hexanoyl-sn-glycero-3-phosphate
1-hexanoyl-sn-glycero-3-phosphate(2-)
LPA 6:0/0:0(2-)
  • Miscellaneous

    • Chemical Class:

      A 1-acyl-sn-glycero-3-phosphate(2-) in which the acyl group is specified as caproyl (hexanoyl). ChEBI CHEBI:78223

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

Density:
Boiling Point: 463.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.5±6.0 kJ/mol
Flash Point: 233.9±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.32
ACD/LogD (pH 5.5): -3.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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