ChemSpider 2D Image | 2-(3,4-Dimethoxyphenyl)-3,6,7-trimethoxy-4-oxo-4H-chromen-5-yl acetate | C22H22O9

2-(3,4-Dimethoxyphenyl)-3,6,7-trimethoxy-4-oxo-4H-chromen-5-yl acetate

  • Molecular FormulaC22H22O9
  • Average mass430.405 Da
  • Monoisotopic mass430.126373 Da
  • ChemSpider ID28424304

More details:






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

2-(3,4-Dimethoxyphenyl)-3,6,7-trimethoxy-4-oxo-4H-chromen-5-yl acetate [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenyl)-3,6,7-trimethoxy-4-oxo-4H-chromen-5-yl-acetat [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 5-(acetyloxy)-2-(3,4-dimethoxyphenyl)-3,6,7-trimethoxy- [ACD/Index Name]
Acétate de 2-(3,4-diméthoxyphényl)-3,6,7-triméthoxy-4-oxo-4H-chromén-5-yle [French] [ACD/IUPAC Name]
[95135-98-1]
95135-98-1 [RN]
Artemetin acetate
MFCD20260424

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

Density: 1.3±0.1 g/cm3
Boiling Point: 589.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 255.9±30.2 °C
Index of Refraction: 1.584
Molar Refractivity: 107.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.36
ACD/KOC (pH 5.5): 455.72
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.36
ACD/KOC (pH 7.4): 455.72
Polar Surface Area: 99 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 54.0±5.0 dyne/cm
Molar Volume: 321.2±5.0 cm3

Click to predict properties on the Chemicalize site






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