Found 37 results

Search term: MF = 'C_{8}H_{6}Br_{2}N_{2}S'
ChemSpider 2D Image | 4,6-Dibromo-3-isothiocyanato-2-methylaniline | C8H6Br2N2S

4,6-Dibromo-3-isothiocyanato-2-methylaniline

  • Molecular FormulaC8H6Br2N2S
  • Average mass322.020 Da
  • Monoisotopic mass319.861816 Da
  • ChemSpider ID60788315

More details:

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

4,6-Dibrom-3-isothiocyanato-2-methylanilin [German] [ACD/IUPAC Name]
4,6-Dibromo-3-isothiocyanato-2-methylaniline [ACD/IUPAC Name]
4,6-Dibromo-3-isothiocyanato-2-méthylaniline [French] [ACD/IUPAC Name]
Benzenamine, 4,6-dibromo-3-isothiocyanato-2-methyl- [ACD/Index Name]
1379306-97-4 [RN]
MFCD20257211

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

Density: 1.9±0.1 g/cm3
Boiling Point: 399.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 195.4±27.9 °C
Index of Refraction: 1.692
Molar Refractivity: 64.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 4.54
ACD/BCF (pH 5.5): 1662.61
ACD/KOC (pH 5.5): 7031.35
ACD/LogD (pH 7.4): 4.54
ACD/BCF (pH 7.4): 1662.64
ACD/KOC (pH 7.4): 7031.44
Polar Surface Area: 70 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 49.5±7.0 dyne/cm
Molar Volume: 167.3±7.0 cm3

Click to predict properties on the Chemicalize site


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