ChemSpider 2D Image | Hydrangenol | C15H12O4

Hydrangenol

  • Molecular FormulaC15H12O4
  • Average mass256.253 Da
  • Monoisotopic mass256.073547 Da
  • ChemSpider ID26360708

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-8-Hydroxy-3-(4-hydroxyphenyl)-3,4-dihydro-1H-isochromen-1-on [German] [ACD/IUPAC Name]
(3R)-8-Hydroxy-3-(4-hydroxyphenyl)-3,4-dihydro-1H-isochromen-1-one [ACD/IUPAC Name]
(3R)-8-Hydroxy-3-(4-hydroxyphényl)-3,4-dihydro-1H-isochromén-1-one [French] [ACD/IUPAC Name]
1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(4-hydroxyphenyl)-, (3R)- [ACD/Index Name]
Hydrangenol [Wiki]
3,4-Dihydro-8-hydroxy-3-(4-hydroxyphenyl)-1H-2-benzopyran-1-one
3,4-Dihydro-8-hydroxy-3-(p-hydroxyphenyl)-isocoumarin
480-47-7 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 528.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 206.4±23.6 °C
Index of Refraction: 1.662
Molar Refractivity: 68.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 291.87
ACD/KOC (pH 5.5): 2023.80
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 288.80
ACD/KOC (pH 7.4): 2002.52
Polar Surface Area: 67 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 184.8±3.0 cm3

Click to predict properties on the Chemicalize site


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