Found 114 results

Search term: MF = 'C_{10}H_{9}BrN_{2}O_{4}S'
ChemSpider 2D Image | 1-Cyanoethyl 2-bromo-5-sulfamoylbenzoate | C10H9BrN2O4S

1-Cyanoethyl 2-bromo-5-sulfamoylbenzoate

  • Molecular FormulaC10H9BrN2O4S
  • Average mass333.159 Da
  • Monoisotopic mass331.946625 Da
  • ChemSpider ID30542679

More details:

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

1-Cyanethyl-2-brom-5-sulfamoylbenzoat [German] [ACD/IUPAC Name]
1-Cyanoethyl 2-bromo-5-sulfamoylbenzoate [ACD/IUPAC Name]
2-Bromo-5-sulfamoylbenzoate de 1-cyanoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 5-(aminosulfonyl)-2-bromo-, 1-cyanoethyl ester [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 546.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.6±3.0 kJ/mol
Flash Point: 284.5±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 67.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 6.07
ACD/KOC (pH 5.5): 126.59
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 6.03
ACD/KOC (pH 7.4): 125.58
Polar Surface Area: 119 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 199.2±3.0 cm3

Click to predict properties on the Chemicalize site


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