ChemSpider 2D Image | 5-Chloro-2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole | C16H14ClNO3S

5-Chloro-2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole

  • Molecular FormulaC16H14ClNO3S
  • Average mass335.805 Da
  • Monoisotopic mass335.038300 Da
  • ChemSpider ID30658159

More details:

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

5-Chlor-2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazol [German] [ACD/IUPAC Name]
5-Chloro-2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole [ACD/IUPAC Name]
5-Chloro-2-(3,4,5-triméthoxyphényl)-1,3-benzothiazole [French] [ACD/IUPAC Name]
Benzothiazole, 5-chloro-2-(3,4,5-trimethoxyphenyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 476.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 242.2±31.5 °C
Index of Refraction: 1.623
Molar Refractivity: 90.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.19
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 909.39
ACD/KOC (pH 5.5): 4565.33
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 909.39
ACD/KOC (pH 7.4): 4565.35
Polar Surface Area: 69 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 255.5±3.0 cm3

Click to predict properties on the Chemicalize site


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