ChemSpider 2D Image | (5R)-5-[(1S)-1,2-Dihydroxyethyl]-2,4-di-O-phosphono-alpha-D-lyxopyranose | C7H16O13P2

(5R)-5-[(1S)-1,2-Dihydroxyethyl]-2,4-di-O-phosphono-α-D-lyxopyranose

  • Molecular FormulaC7H16O13P2
  • Average mass370.142 Da
  • Monoisotopic mass370.006622 Da
  • ChemSpider ID128434318

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(5R)-5-[(1S)-1,2-Dihydroxyethyl]-2,4-di-O-phosphono-α-D-lyxopyranose [German] [ACD/IUPAC Name]
(5R)-5-[(1S)-1,2-Dihydroxyethyl]-2,4-di-O-phosphono-α-D-lyxopyranose [ACD/IUPAC Name]
(5R)-5-[(1S)-1,2-Dihydroxyéthyl]-2,4-di-O-phosphono-α-D-lyxopyranose [French] [ACD/IUPAC Name]
L-glycero-α-D-manno-Heptopyranose, 2,4-bis(dihydrogen phosphate) [ACD/Index Name]
2,4-di-O-phosphono-L-glycero-α-D-manno-heptopyranose
D-glycero-α-D-manno-heptopyranose 2,4-bisphosphate
D-glycero-α-D-manno-heptose 2,4-bisphosphate
heptose 2,4-bisphosphate
  • Miscellaneous

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

Density: 2.1±0.1 g/cm3
Boiling Point: 857.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 141.6±6.0 kJ/mol
Flash Point: 472.4±37.1 °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: -3.47
ACD/LogD (pH 5.5): -9.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.63
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


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