ChemSpider 2D Image | 1,7-di-O-phosphono-L-glycero-beta-D-manno-heptopyranose | C7H16O13P2

1,7-di-O-phosphono-L-glycero-β-D-manno-heptopyranose

  • Molecular FormulaC7H16O13P2
  • Average mass370.142 Da
  • Monoisotopic mass370.006622 Da
  • ChemSpider ID25056928

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(5R)-5-[(1S)-1-Hydroxy-2-(phosphonooxy)ethyl]-1-O-phosphono-β-D-lyxopyranose [ACD/IUPAC Name]
(5R)-5-[(1S)-1-Hydroxy-2-(phosphonooxy)ethyl]-1-O-phosphono-β-D-lyxopyranose [German] [ACD/IUPAC Name]
(5R)-5-[(1S)-1-Hydroxy-2-(phosphonooxy)éthyl]-1-O-phosphono-β-D-lyxopyranose [French] [ACD/IUPAC Name]
1,7-di-O-phosphono-L-glycero-β-D-manno-heptopyranose
L-glycero-β-D-manno-Heptopyranose, 1,7-bis(dihydrogen phosphate) [ACD/Index Name]
GMB

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

Density: 2.1±0.1 g/cm3
Boiling Point: 790.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.0±6.0 kJ/mol
Flash Point: 431.7±35.7 °C
Index of Refraction: 1.620
Molar Refractivity: 63.3±0.4 cm3
#H bond acceptors: 13
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.05
ACD/LogD (pH 5.5): -8.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 243 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 130.4±5.0 dyne/cm
Molar Volume: 180.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement