ChemSpider 2D Image | 2-(3-Methyl-2-buten-1-yl)-9-oxo-9H-xanthene-1,3,6-triyl triacetate | C24H22O8

2-(3-Methyl-2-buten-1-yl)-9-oxo-9H-xanthene-1,3,6-triyl triacetate

  • Molecular FormulaC24H22O8
  • Average mass438.427 Da
  • Monoisotopic mass438.131470 Da
  • ChemSpider ID28711625

More details:

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

2-(3-Methyl-2-buten-1-yl)-9-oxo-9H-xanthen-1,3,6-triyl-triacetat [German] [ACD/IUPAC Name]
2-(3-Methyl-2-buten-1-yl)-9-oxo-9H-xanthene-1,3,6-triyl triacetate [ACD/IUPAC Name]
9H-Xanthen-9-one, 1,3,6-tris(acetyloxy)-2-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
Triacétate de 2-(3-méthyl-2-butén-1-yl)-9-oxo-9H-xanthène-1,3,6-triyle [French] [ACD/IUPAC Name]
1,6-BIS(ACETYLOXY)-2-(3-METHYLBUT-2-EN-1-YL)-9-OXO-9H-XANTHEN-3-YL ACETATE
1,6-BIS(ACETYLOXY)-2-(3-METHYLBUT-2-EN-1-YL)-9-OXOXANTHEN-3-YL ACETATE
2-(3-Methylbut-2-en-1-yl)-9-oxo-9H-xanthene-1,3,6-triyl triacetate
94169-05-8 [RN]
9H-XANTHEN-9-ONE, 1,3,6-TRIS(ACETYLOXY)-2-(3-METHYL-2-BUTENYL)-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 592.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.3±3.0 kJ/mol
Flash Point: 255.6±30.2 °C
Index of Refraction: 1.574
Molar Refractivity: 112.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 514.36
ACD/KOC (pH 5.5): 3036.19
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 514.36
ACD/KOC (pH 7.4): 3036.19
Polar Surface Area: 105 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 48.7±3.0 dyne/cm
Molar Volume: 342.3±3.0 cm3

Click to predict properties on the Chemicalize site


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