ChemSpider 2D Image | Sudexanox | C21H23NO5S

Sudexanox

  • Molecular FormulaC21H23NO5S
  • Average mass401.476 Da
  • Monoisotopic mass401.129700 Da
  • ChemSpider ID32699739

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

58761-87-8 [RN]
5-Hexyl-7-(S-methylsulfonimidoyl)-9-oxo-9H-xanthen-2-carbonsäure [German] [ACD/IUPAC Name]
5-Hexyl-7-(S-methylsulfonimidoyl)-9-oxo-9H-xanthene-2-carboxylic acid [ACD/IUPAC Name]
9H-Xanthene-2-carboxylic acid, 5-hexyl-7-(S-methylsulfonimidoyl)-9-oxo- [ACD/Index Name]
Acide 5-hexyl-7-(S-méthylsulfonimidoyl)-9-oxo-9H-xanthène-2-carboxylique [French] [ACD/IUPAC Name]
H6C0F5AD7D
Sudexanox [INN]
UNII:H6C0F5AD7D
UNII-H6C0F5AD7D

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

4839 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 609.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 322.2±34.3 °C
Index of Refraction: 1.622
Molar Refractivity: 106.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.76
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 113 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 50.8±7.0 dyne/cm
Molar Volume: 301.4±7.0 cm3

Click to predict properties on the Chemicalize site


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