ChemSpider 2D Image | 2-O-(alpha-D-glucopyranosyl)-3-O-phospho-D-glyceric acid | C9H17O12P

2-O-(α-D-glucopyranosyl)-3-O-phospho-D-glyceric acid

  • Molecular FormulaC9H17O12P
  • Average mass348.198 Da
  • Monoisotopic mass348.045776 Da
  • ChemSpider ID26332784

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2R)-2-(α-D-Glucopyranosyloxy)-3-(phosphonooxy)propanoic acid [ACD/IUPAC Name]
(2R)-2-(α-D-Glucopyranosyloxy)-3-(phosphonooxy)propansäure [German] [ACD/IUPAC Name]
2-O-(α-D-glucopyranosyl)-3-O-phospho-D-glyceric acid
Acide (2R)-2-(α-D-glucopyranosyloxy)-3-(phosphonooxy)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 2-(α-D-glucopyranosyloxy)-3-(phosphonooxy)-, (2R)- [ACD/Index Name]
2-(α-D-glucopyranosyl)-3-phospho-D-glyceric acid
2-(α-D-glucosyl)-3-phospho-D-glyceric acid
2-O-(α-D-glucosyl)-3-O-phospho-D-glyceric acid
XDX

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

Density: 1.9±0.1 g/cm3
Boiling Point: 767.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.4±6.0 kJ/mol
Flash Point: 417.8±35.7 °C
Index of Refraction: 1.607
Molar Refractivity: 64.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -3.89
ACD/LogD (pH 5.5): -8.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 213 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 111.1±5.0 dyne/cm
Molar Volume: 186.4±5.0 cm3

Click to predict properties on the Chemicalize site


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