ChemSpider 2D Image | 2-(2,2-Dimethylpropyl)benzothiazole | C12H15NS

2-(2,2-Dimethylpropyl)benzothiazole

  • Molecular FormulaC12H15NS
  • Average mass205.319 Da
  • Monoisotopic mass205.092514 Da
  • ChemSpider ID24182679

More details:

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

17147-82-9 [RN]
2-(2,2-Dimethylpropyl)-1,3-benzothiazol [German] [ACD/IUPAC Name]
2-(2,2-Dimethylpropyl)-1,3-benzothiazole [ACD/IUPAC Name]
2-(2,2-Diméthylpropyl)-1,3-benzothiazole [French] [ACD/IUPAC Name]
2-(2,2-Dimethylpropyl)benzothiazole
Benzothiazole, 2-(2,2-dimethylpropyl)- [ACD/Index Name]
2-neopentylbenzo[d]thiazole
BENZO[D]THIAZOLE,2-(2,2-DIMETHYLPROPYL)-
Benzothiazole, 2-(2,2-dimethylpropyl)- (9CI)
Benzothiazole,2-(2,2-dimethylpropyl)-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 289.6±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.8±3.0 kJ/mol
Flash Point: 123.7±7.6 °C
Index of Refraction: 1.594
Molar Refractivity: 64.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 4.19
ACD/BCF (pH 5.5): 906.14
ACD/KOC (pH 5.5): 4553.48
ACD/LogD (pH 7.4): 4.19
ACD/BCF (pH 7.4): 906.27
ACD/KOC (pH 7.4): 4554.11
Polar Surface Area: 41 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 188.6±3.0 cm3

Click to predict properties on the Chemicalize site


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