ChemSpider 2D Image | 3-Bromo-4-(dimethylsulfamoyl)benzoic acid | C9H10BrNO4S

3-Bromo-4-(dimethylsulfamoyl)benzoic acid

  • Molecular FormulaC9H10BrNO4S
  • Average mass308.149 Da
  • Monoisotopic mass306.951385 Da
  • ChemSpider ID24363249

More details:

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

3-Brom-4-(dimethylsulfamoyl)benzoesäure [German] [ACD/IUPAC Name]
3-Bromo-4-(dimethylsulfamoyl)benzoic acid [ACD/IUPAC Name]
Acide 3-bromo-4-(diméthylsulfamoyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-4-[(dimethylamino)sulfonyl]- [ACD/Index Name]
1019384-91-8 [RN]
MFCD11131893 [MDL number]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 442.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 221.5±31.5 °C
Index of Refraction: 1.598
Molar Refractivity: 62.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.19
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 183.7±3.0 cm3

Click to predict properties on the Chemicalize site


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