ChemSpider 2D Image | 2-[(~2~H_3_)Methyloxy]-5-sulfamoylbenzoic acid | C8H6D3NO5S

2-[(2H3)Methyloxy]-5-sulfamoylbenzoic acid

  • Molecular FormulaC8H6D3NO5S
  • Average mass234.244 Da
  • Monoisotopic mass234.038971 Da
  • ChemSpider ID62856053

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[(2H3)Methyloxy]-5-sulfamoylbenzoesäure [German] [ACD/IUPAC Name]
2-[(2H3)Methyloxy]-5-sulfamoylbenzoic acid [ACD/IUPAC Name]
Acide 2-[(2H3)méthyloxy]-5-sulfamoylbenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 5-(aminosulfonyl)-2-(methyl-d3-oxy)- [ACD/Index Name]
123958-85-0 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 482.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 245.6±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 51.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.23
ACD/LogD (pH 5.5): -1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 60.5±3.0 dyne/cm
Molar Volume: 154.9±3.0 cm3

Click to predict properties on the Chemicalize site


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