ChemSpider 2D Image | 2-(Hydroxymethyl)phenyl hexopyranoside | C13H18O7

2-(Hydroxymethyl)phenyl hexopyranoside

  • Molecular FormulaC13H18O7
  • Average mass286.278 Da
  • Monoisotopic mass286.105255 Da
  • ChemSpider ID21201489

More details:

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

2-(Hydroxymethyl)phenyl hexopyranoside [ACD/IUPAC Name]
2-(Hydroxymethyl)phenylhexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside de 2-(hydroxyméthyl)phényle [French] [ACD/IUPAC Name]
Hexopyranoside, 2-(hydroxymethyl)phenyl [ACD/Index Name]
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
2-Hydroxymethyl-6-(2-hydroxymethyl-phenoxy)-tetrahydro-pyran-3,4,5-triol
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL334657/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 549.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 285.9±30.1 °C
Index of Refraction: 1.638
Molar Refractivity: 68.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.85
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.72
ACD/LogD (pH 7.4): -1.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.72
Polar Surface Area: 120 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 70.1±3.0 dyne/cm
Molar Volume: 190.3±3.0 cm3

Click to predict properties on the Chemicalize site


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