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Search term: 24845983 (Found by CSID)
ChemSpider 2D Image | (2E)-1-[5,7-Dihydroxy-2,2-dimethyl-6-(3-methyl-2-buten-1-yl)-2H-chromen-8-yl]-3-(4-hydroxyphenyl)-2-propen-1-one | C25H26O5

(2E)-1-[5,7-Dihydroxy-2,2-dimethyl-6-(3-methyl-2-buten-1-yl)-2H-chromen-8-yl]-3-(4-hydroxyphenyl)-2-propen-1-one

  • Molecular FormulaC25H26O5
  • Average mass406.471 Da
  • Monoisotopic mass406.178009 Da
  • ChemSpider ID24845983

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-[5,7-Dihydroxy-2,2-dimethyl-6-(3-methyl-2-buten-1-yl)-2H-chromen-8-yl]-3-(4-hydroxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[5,7-Dihydroxy-2,2-dimethyl-6-(3-methyl-2-buten-1-yl)-2H-chromen-8-yl]-3-(4-hydroxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[5,7-Dihydroxy-2,2-diméthyl-6-(3-méthyl-2-butén-1-yl)-2H-chromén-8-yl]-3-(4-hydroxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[5,7-dihydroxy-2,2-dimethyl-6-(3-methyl-2-buten-1-yl)-2H-1-benzopyran-8-yl]-3-(4-hydroxyphenyl)-, (2E)- [ACD/Index Name]
(2E)-1-[5,7-dihydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-2H-chromen-8-yl]-3-(4-hydroxyphenyl)prop-2-en-1-one
3'-Prenyl-6'',6''-dimethylpyrano[2'',3'':6',5']-4,2',4'-trihydroxychalcone
Xanthohumol E

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

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

Density: 1.2±0.1 g/cm3
Boiling Point: 646.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.7±3.0 kJ/mol
Flash Point: 221.8±25.0 °C
Index of Refraction: 1.638
Molar Refractivity: 118.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.92
ACD/LogD (pH 5.5): 6.01
ACD/BCF (pH 5.5): 21585.79
ACD/KOC (pH 5.5): 43923.45
ACD/LogD (pH 7.4): 5.74
ACD/BCF (pH 7.4): 11745.14
ACD/KOC (pH 7.4): 23899.37
Polar Surface Area: 87 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 330.4±3.0 cm3

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