ChemSpider 2D Image | 2-bromo-6-(trifluoromethyl)benzo[d]thiazole | C8H3BrF3NS

2-bromo-6-(trifluoromethyl)benzo[d]thiazole

  • Molecular FormulaC8H3BrF3NS
  • Average mass282.080 Da
  • Monoisotopic mass280.912170 Da
  • ChemSpider ID24597875

More details:

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

2-Brom-6-(trifluormethyl)-1,3-benzothiazol [German] [ACD/IUPAC Name]
2-Bromo-6-(trifluoromethyl)-1,3-benzothiazole [ACD/IUPAC Name]
2-Bromo-6-(trifluorométhyl)-1,3-benzothiazole [French] [ACD/IUPAC Name]
2-bromo-6-(trifluoromethyl)benzo[d]thiazole
898748-23-7 [RN]
Benzothiazole, 2-bromo-6-(trifluoromethyl)- [ACD/Index Name]
MFCD08459023 [MDL number]
2-Benzyl-2-azabicyclo[2.2.2]octan-6-ol [ACD/IUPAC Name]
2-Bromo-6-(trifluoromethyl)benzothiazole
2-bromo-6-trifluoromethylbenzothiazole
More...

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

CCRIS 4693 [DBID]
  • Miscellaneous

    • Safety:

      H302+H312+H332 W&J PharmaChem, Inc. 201073
      P302+P352+P304+P312+P503+P351+P338+P403+P235+P280+P260 W&J PharmaChem, Inc. 201073

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

Density: 1.8±0.1 g/cm3
Boiling Point: 297.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.6±3.0 kJ/mol
Flash Point: 134.0±30.1 °C
Index of Refraction: 1.598
Molar Refractivity: 53.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.15
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 411.37
ACD/KOC (pH 5.5): 2587.44
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 411.37
ACD/KOC (pH 7.4): 2587.44
Polar Surface Area: 41 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 155.9±3.0 cm3

Click to predict properties on the Chemicalize site


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