ChemSpider 2D Image | 4-(2-hydroxy-3-(phosphonooxy)propyl)?-D-glucopyranoside | C9H19O11P

4-(2-hydroxy-3-(phosphonooxy)propyl)?-D-glucopyranoside

  • Molecular FormulaC9H19O11P
  • Average mass334.214 Da
  • Monoisotopic mass334.066498 Da
  • ChemSpider ID52084460

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

4-(2-hydroxy-3-(phosphonooxy)propyl)?-D-glucopyranoside
4-O-[2-Hydroxy-3-(phosphonooxy)propyl]-α-D-glucopyranose [German] [ACD/IUPAC Name]
4-O-[2-Hydroxy-3-(phosphonooxy)propyl]-α-D-glucopyranose [ACD/IUPAC Name]
4-O-[2-Hydroxy-3-(phosphonooxy)propyl]-α-D-glucopyranose [French] [ACD/IUPAC Name]
α-D-Glucopyranose, 4-O-[2-hydroxy-3-(phosphonooxy)propyl]- [ACD/Index Name]
α-D-GLUCOPYRANOSIDE, 4-(2-HYDROXY-3-(PHOSPHONOOXY)PROPYL)

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

UNII:WN1E5V21GH [DBID]
WN1E5V21GH [DBID]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 705.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.0±6.0 kJ/mol
Flash Point: 380.6±35.7 °C
Index of Refraction: 1.593
Molar Refractivity: 64.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.92
ACD/LogD (pH 5.5): -6.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 196 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 100.6±5.0 dyne/cm
Molar Volume: 189.5±5.0 cm3

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