ChemSpider 2D Image | 1,8-Dihydroxy-4,6-dimethoxy-9-oxo-9H-xanthene-2-carboxylic acid | C16H12O8

1,8-Dihydroxy-4,6-dimethoxy-9-oxo-9H-xanthene-2-carboxylic acid

  • Molecular FormulaC16H12O8
  • Average mass332.262 Da
  • Monoisotopic mass332.053223 Da
  • ChemSpider ID28679950

More details:

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

1,8-Dihydroxy-4,6-dimethoxy-9-oxo-9H-xanthen-2-carbonsäure [German] [ACD/IUPAC Name]
1,8-Dihydroxy-4,6-dimethoxy-9-oxo-9H-xanthene-2-carboxylic acid [ACD/IUPAC Name]
9H-Xanthene-2-carboxylic acid, 1,8-dihydroxy-4,6-dimethoxy-9-oxo- [ACD/Index Name]
Acide 1,8-dihydroxy-4,6-diméthoxy-9-oxo-9H-xanthène-2-carboxylique [French] [ACD/IUPAC Name]
1,8-DIHYDROXY-4,6-DIMETHOXY-9-OXOXANTHENE-2-CARBOXYLIC ACID
125850-40-0 [RN]
9H-XANTHENE-2-CARBOXYLICACID, 1,8-DIHYDROXY-4,6-DIMETHOXY-9-OXO-

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

Density: 1.6±0.1 g/cm3
Boiling Point: 665.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 251.9±25.0 °C
Index of Refraction: 1.678
Molar Refractivity: 79.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.27
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.06
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 73.6±3.0 dyne/cm
Molar Volume: 211.0±3.0 cm3

Click to predict properties on the Chemicalize site


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