ChemSpider 2D Image | 2,5-Anhydro-1-deoxy-1-phosphono-6-O-phosphono-L-mannitol | C6H14O10P2

2,5-Anhydro-1-deoxy-1-phosphono-6-O-phosphono-L-mannitol

  • Molecular FormulaC6H14O10P2
  • Average mass308.117 Da
  • Monoisotopic mass308.006226 Da
  • ChemSpider ID26329716
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

2,5-Anhydro-1-deoxy-1-phosphono-6-O-phosphono-L-mannitol [ACD/IUPAC Name]
2,5-Anhydro-1-desoxy-1-phosphono-6-O-phosphono-L-mannitol [German] [ACD/IUPAC Name]
2,5-Anhydro-1-désoxy-1-phosphono-6-O-phosphono-L-mannitol [French] [ACD/IUPAC Name]
D-GLUCO-2,5-ANHYDRO-1-DEOXY-1-PHOSPHONOHEXITOL-6-PHOSPHATE
L-Mannitol, 2,5-anhydro-1-deoxy-1-phosphono-, 6-(dihydrogen phosphate) [ACD/Index Name]
[(2R,3R,4R,5S)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]methylphosphonic acid
{[(2R,3R,4R,5S)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]methyl}phosphonic acid

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

Density: 1.9±0.1 g/cm3
Boiling Point: 719.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 120.1±6.0 kJ/mol
Flash Point: 389.0±35.7 °C
Index of Refraction: 1.591
Molar Refractivity: 54.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -3.00
ACD/LogD (pH 5.5): -8.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 194 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 108.1±3.0 dyne/cm
Molar Volume: 160.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement