ChemSpider 2D Image | 4-Bromo-N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methylbenzenesulfonamide | C12H12BrCl2N3O2S

4-Bromo-N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methylbenzenesulfonamide

  • Molecular FormulaC12H12BrCl2N3O2S
  • Average mass413.118 Da
  • Monoisotopic mass410.921051 Da
  • ChemSpider ID21759784

More details:

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

4-Brom-N-[(4,5-dichlor-1-methyl-1H-pyrazol-3-yl)methyl]-N-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
4-Bromo-N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methylbenzenesulfonamide [ACD/IUPAC Name]
4-Bromo-N-[(4,5-dichloro-1-méthyl-1H-pyrazol-3-yl)méthyl]-N-méthylbenzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-bromo-N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methyl- [ACD/Index Name]
[(4,5-dichloro-1-methylpyrazol-3-yl)methyl][(4-bromophenyl)sulfonyl]methylamine
4-Bromo-N-(4,5-dichloro-1-methyl-1H-pyrazol-3-ylmethyl)-N-methyl-benzenesulfonamide

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

Density: 1.7±0.1 g/cm3
Boiling Point: 517.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 266.8±32.9 °C
Index of Refraction: 1.655
Molar Refractivity: 89.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 586.38
ACD/KOC (pH 5.5): 3334.77
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 586.38
ACD/KOC (pH 7.4): 3334.77
Polar Surface Area: 64 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 53.9±7.0 dyne/cm
Molar Volume: 244.9±7.0 cm3

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