ChemSpider 2D Image | 5-[(6S)-6-(2-Hydroxy-2-propanyl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]-1,3-benzenediol | C19H18O5

5-[(6S)-6-(2-Hydroxy-2-propanyl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]-1,3-benzenediol

  • Molecular FormulaC19H18O5
  • Average mass326.343 Da
  • Monoisotopic mass326.115417 Da
  • ChemSpider ID113610304

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1,3-Benzenediol, 5-[(6S)-5,6-dihydro-6-(1-hydroxy-1-methylethyl)benzo[1,2-b:5,4-b']difuran-2-yl]- [ACD/Index Name]
5-[(6S)-6-(2-Hydroxy-2-propanyl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]-1,3-benzenediol [ACD/IUPAC Name]
5-[(6S)-6-(2-Hydroxy-2-propanyl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]-1,3-benzènediol [French] [ACD/IUPAC Name]
5-[(6S)-6-(2-Hydroxy-2-propanyl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]-1,3-benzoldiol [German] [ACD/IUPAC 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: 557.0±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 290.6±26.8 °C
Index of Refraction: 1.679
Molar Refractivity: 89.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 3.14
ACD/BCF (pH 5.5): 143.59
ACD/KOC (pH 5.5): 1218.02
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 140.80
ACD/KOC (pH 7.4): 1194.30
Polar Surface Area: 83 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 63.9±3.0 dyne/cm
Molar Volume: 235.9±3.0 cm3

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