ChemSpider 2D Image | (3S,4R)-4-Hydroxytetrahydro-3-furanyl dihydrogen phosphate | C4H9O6P

(3S,4R)-4-Hydroxytetrahydro-3-furanyl dihydrogen phosphate

  • Molecular FormulaC4H9O6P
  • Average mass184.084 Da
  • Monoisotopic mass184.013672 Da
  • ChemSpider ID23150912

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4R)-4-Hydroxytetrahydro-3-furanyl dihydrogen phosphate [ACD/IUPAC Name]
(3S,4R)-4-Hydroxytetrahydro-3-furanyldihydrogenphosphat [German] [ACD/IUPAC Name]
3,4-Furandiol, tetrahydro-, mono(dihydrogen phosphate), (3S,4R)- [ACD/Index Name]
Dihydrogénophosphate de (3S,4R)-4-hydroxytétrahydro-3-furanyle [French] [ACD/IUPAC Name]
153973-80-9 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL294439/
Phosphoric acid mono-((3S,4R)-4-hydroxy-tetrahydro-furan-3-yl) ester

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

Density: 1.7±0.1 g/cm3
Boiling Point: 459.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.0±6.0 kJ/mol
Flash Point: 231.7±31.5 °C
Index of Refraction: 1.522
Molar Refractivity: 33.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -2.47
ACD/LogD (pH 5.5): -5.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 106 Å2
Polarizability: 13.2±0.5 10-24cm3
Surface Tension: 73.4±5.0 dyne/cm
Molar Volume: 109.2±5.0 cm3

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