ChemSpider 2D Image | 2-Bromo-7-methoxy-1,3-benzothiazole | C8H6BrNOS

2-Bromo-7-methoxy-1,3-benzothiazole

  • Molecular FormulaC8H6BrNOS
  • Average mass244.108 Da
  • Monoisotopic mass242.935333 Da
  • ChemSpider ID30688576

More details:

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

2-Brom-7-methoxy-1,3-benzothiazol [German] [ACD/IUPAC Name]
2-Bromo-7-methoxy-1,3-benzothiazole [ACD/IUPAC Name]
2-Bromo-7-méthoxy-1,3-benzothiazole [French] [ACD/IUPAC Name]
3622-45-5 [RN]
Benzothiazole, 2-bromo-7-methoxy- [ACD/Index Name]
2-Bromo-7-methoxybenzo[d]thiazole
2-Bromo-7-methoxybenzothiazole
2-Bromo-7-methoxy-benzothiazole
MFCD09749266
  • Miscellaneous

    • Safety:

      H302+H312+H332 W&J PharmaChem, Inc. 203753
      P302+P352+P304+P312+P503+P351+P338+P403+P235+P280+P260 W&J PharmaChem, Inc. 203753

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

Density: 1.7±0.1 g/cm3
Boiling Point: 335.4±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 156.6±25.7 °C
Index of Refraction: 1.674
Molar Refractivity: 54.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.89
ACD/BCF (pH 5.5): 92.06
ACD/KOC (pH 5.5): 886.09
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 92.06
ACD/KOC (pH 7.4): 886.09
Polar Surface Area: 50 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 146.4±3.0 cm3

Click to predict properties on the Chemicalize site


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