ChemSpider 2D Image | 7-(Dimethylsulfamoyl)-9-oxo-9H-xanthene-2-carboxylic acid | C16H13NO6S

7-(Dimethylsulfamoyl)-9-oxo-9H-xanthene-2-carboxylic acid

  • Molecular FormulaC16H13NO6S
  • Average mass347.342 Da
  • Monoisotopic mass347.046356 Da
  • ChemSpider ID15233565

More details:

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

7-(Dimethylsulfamoyl)-9-oxo-9H-xanthen-2-carbonsäure [German] [ACD/IUPAC Name]
7-(Dimethylsulfamoyl)-9-oxo-9H-xanthene-2-carboxylic acid [ACD/IUPAC Name]
9H-Xanthene-2-carboxylic acid, 7-[(dimethylamino)sulfonyl]-9-oxo- [ACD/Index Name]
Acide 7-(diméthylsulfamoyl)-9-oxo-9H-xanthène-2-carboxylique [French] [ACD/IUPAC Name]
7-(DIMETHYLSULFAMOYL)-9-OXOXANTHENE-2-CARBOXYLIC ACID
7-(N,N-Dimethylsulfamoyl)-9-oxo-9H-xanthene-2-carboxylic acid
74733-76-9 [RN]
7-Dimethylsulfamoyl-9-oxo-9H-xanthene-2-carboxylic acid
7-Dimethylsulfamoylxanthone-2-carboxylic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL282245/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 602.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 318.0±34.3 °C
Index of Refraction: 1.646
Molar Refractivity: 84.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 1.67
ACD/KOC (pH 5.5): 15.91
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 231.7±3.0 cm3

Click to predict properties on the Chemicalize site


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