ChemSpider 2D Image | Daidzein-d4 | C15H6D4O4

Daidzein-d4

  • Molecular FormulaC15H6D4O4
  • Average mass258.262 Da
  • Monoisotopic mass258.083008 Da
  • ChemSpider ID24533577
  • Non-standard isotope - Non-standard isotope


More details:






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

1219803-57-2 [RN]
4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-hydroxyphenyl-2,3,5,6-d4)- [ACD/Index Name]
7-Hydroxy-3-[4-hydroxy(2H4)phenyl]-4H-chromen-4-on [German] [ACD/IUPAC Name]
7-Hydroxy-3-[4-hydroxy(2H4)phenyl]-4H-chromen-4-one [ACD/IUPAC Name]
7-Hydroxy-3-[4-hydroxy(2H4)phényl]-4H-chromén-4-one [French] [ACD/IUPAC Name]
Daidzein-d4
4',7-Dihydroxyisoflavone
7-Hydroxy-3(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-hydroxy-3-(4-hydroxyphenyl-2,3,5,6-d4)-4H-1-benzopyran-4-one
Daidzein-d4 (4-hydroxyphenyl-2,3,5,6-d4)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 512.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 201.2±23.6 °C
Index of Refraction: 1.699
Molar Refractivity: 68.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 2.89
ACD/BCF (pH 5.5): 92.60
ACD/KOC (pH 5.5): 882.49
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 28.45
ACD/KOC (pH 7.4): 271.15
Polar Surface Area: 67 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 68.2±3.0 dyne/cm
Molar Volume: 176.1±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement