ChemSpider 2D Image | (2S)-4-(2,4-Dihydroxyphenyl)-2-butanyl beta-D-xylopyranoside | C15H22O7

(2S)-4-(2,4-Dihydroxyphenyl)-2-butanyl β-D-xylopyranoside

  • Molecular FormulaC15H22O7
  • Average mass314.331 Da
  • Monoisotopic mass314.136566 Da
  • ChemSpider ID31128737

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(2S)-4-(2,4-Dihydroxyphenyl)-2-butanyl β-D-xylopyranoside [ACD/IUPAC Name]
(2S)-4-(2,4-Dihydroxyphenyl)-2-butanyl-β-D-xylopyranosid [German] [ACD/IUPAC Name]
β-D-Xylopyranoside de (2S)-4-(2,4-dihydroxyphényl)-2-butanyle [French] [ACD/IUPAC Name]
β-D-Xylopyranoside, (1S)-3-(2,4-dihydroxyphenyl)-1-methylpropyl [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 564.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 295.3±30.1 °C
Index of Refraction: 1.619
Molar Refractivity: 77.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.23
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.75
ACD/KOC (pH 5.5): 52.06
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.75
ACD/KOC (pH 7.4): 51.77
Polar Surface Area: 120 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 73.7±5.0 dyne/cm
Molar Volume: 220.8±5.0 cm3

Click to predict properties on the Chemicalize site


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