ChemSpider 2D Image | (2S)-5,7-Dihydroxy-2-[4-hydroxy(~2~H_4_)phenyl]-2,3-dihydro-4H-chromen-4-one | C15H8D4O5

(2S)-5,7-Dihydroxy-2-[4-hydroxy(2H4)phenyl]-2,3-dihydro-4H-chromen-4-one

  • Molecular FormulaC15H8D4O5
  • Average mass276.277 Da
  • Monoisotopic mass276.093567 Da
  • ChemSpider ID123963128

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S)-5,7-Dihydroxy-2-[4-hydroxy(2H4)phenyl]-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
(2S)-5,7-Dihydroxy-2-[4-hydroxy(2H4)phenyl]-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
(2S)-5,7-Dihydroxy-2-[4-hydroxy(2H4)phényl]-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl-2,3,5,6-d4)-, (2S)- [ACD/Index Name]
1192260-78-8 [RN]
Naringenin-d4

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

Density: 1.5±0.1 g/cm3
Boiling Point: 577.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 224.7±23.6 °C
Index of Refraction: 1.693
Molar Refractivity: 70.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 56.63
ACD/KOC (pH 5.5): 622.64
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 23.10
ACD/KOC (pH 7.4): 253.99
Polar Surface Area: 87 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 72.9±3.0 dyne/cm
Molar Volume: 183.3±3.0 cm3

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