ChemSpider 2D Image | diplotrin A | C19H18O8

diplotrin A

  • Molecular FormulaC19H18O8
  • Average mass374.341 Da
  • Monoisotopic mass374.100159 Da
  • ChemSpider ID28486750

More details:

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

1332481-38-5 [RN]
2-(2,5-Dihydroxy-4-methoxyphenyl)-3,7,8-trimethoxy-4H-1-benzopyran-4-one
2-(2,5-Dihydroxy-4-methoxyphenyl)-3,7,8-trimethoxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
2-(2,5-Dihydroxy-4-methoxyphenyl)-3,7,8-trimethoxy-4H-chromen-4-one [ACD/IUPAC Name]
2-(2,5-Dihydroxy-4-méthoxyphényl)-3,7,8-triméthoxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-(2,5-dihydroxy-4-methoxyphenyl)-3,7,8-trimethoxy- [ACD/Index Name]
diplotrin A
2',5'-dihydroxy-3,7,8,4'-tetramethoxyflavone
  • Miscellaneous

    • Chemical Class:

      A dihydroxyflavone that is flavone substituted by hydroxy groups at positions 2' and 5' and methoxy groups at positions 3, 7, 8 and 4'. It has been isolated from th; e aerial parts of Mimosa diplotric ha. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:69447
      A dihydroxyflavone that is flavone substituted by hydroxy groups at positions 2' and 5' and methoxy groups at positions 3, 7, 8 and 4'. It has been isolated from the aerial parts of Mimosa diplotricha . ChEBI CHEBI:69447
      A dihydroxyflavone that is flavone substituted by hydroxy groups at positions 2<apostrophe/> and 5<apostrophe/> and methoxy groups at positions 3, 7, 8 and 4<apostrophe/>. It has been isolated from th e aerial parts of <ital>Mimosa diplotricha</ital>. ChEBI CHEBI:69447

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

Density: 1.4±0.1 g/cm3
Boiling Point: 626.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.2±3.0 kJ/mol
Flash Point: 227.0±25.0 °C
Index of Refraction: 1.640
Molar Refractivity: 93.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 23.34
ACD/KOC (pH 5.5): 331.83
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 23.32
ACD/KOC (pH 7.4): 331.46
Polar Surface Area: 104 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 66.6±5.0 dyne/cm
Molar Volume: 258.5±5.0 cm3

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