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Search term: 24845951 (Found by CSID)
ChemSpider 2D Image | (2E)-1-[5,7-Dihydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-(2,5-dihydroxyphenyl)-2-propen-1-one | C25H26O6

(2E)-1-[5,7-Dihydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-(2,5-dihydroxyphenyl)-2-propen-1-one

  • Molecular FormulaC25H26O6
  • Average mass422.470 Da
  • Monoisotopic mass422.172943 Da
  • ChemSpider ID24845951

  • 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-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-(2,5-dihydroxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[5,7-Dihydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-(2,5-dihydroxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[5,7-Dihydroxy-2-méthyl-2-(4-méthyl-3-pentén-1-yl)-2H-chromén-6-yl]-3-(2,5-dihydroxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[5,7-dihydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-1-benzopyran-6-yl]-3-(2,5-dihydroxyphenyl)-, (2E)- [ACD/Index Name]
FLEMIWALLICHIN B

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

Density: 1.3±0.1 g/cm3
Boiling Point: 684.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.0±3.0 kJ/mol
Flash Point: 235.1±25.0 °C
Index of Refraction: 1.650
Molar Refractivity: 120.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 8.69
ACD/LogD (pH 5.5): 6.39
ACD/BCF (pH 5.5): 42105.66
ACD/KOC (pH 5.5): 69915.43
ACD/LogD (pH 7.4): 5.62
ACD/BCF (pH 7.4): 7019.24
ACD/KOC (pH 7.4): 11655.28
Polar Surface Area: 107 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 330.1±3.0 cm3

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