ChemSpider 2D Image | 2-[(2,4-Dimethylphenyl)sulfanyl]-N,N-dipropyl-1,3-benzothiazol-7-amine | C21H26N2S2

2-[(2,4-Dimethylphenyl)sulfanyl]-N,N-dipropyl-1,3-benzothiazol-7-amine

  • Molecular FormulaC21H26N2S2
  • Average mass370.574 Da
  • Monoisotopic mass370.153748 Da
  • ChemSpider ID62794728

More details:






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

2-[(2,4-Dimethylphenyl)sulfanyl]-N,N-dipropyl-1,3-benzothiazol-7-amin [German] [ACD/IUPAC Name]
2-[(2,4-Dimethylphenyl)sulfanyl]-N,N-dipropyl-1,3-benzothiazol-7-amine [ACD/IUPAC Name]
2-[(2,4-Diméthylphényl)sulfanyl]-N,N-dipropyl-1,3-benzothiazol-7-amine [French] [ACD/IUPAC Name]
7-Benzothiazolamine, 2-[(2,4-dimethylphenyl)thio]-N,N-dipropyl- [ACD/Index Name]
851886-51-6 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 511.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.4±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 113.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 8.35
ACD/LogD (pH 5.5): 6.33
ACD/BCF (pH 5.5): 38349.46
ACD/KOC (pH 5.5): 66392.09
ACD/LogD (pH 7.4): 6.34
ACD/BCF (pH 7.4): 38509.93
ACD/KOC (pH 7.4): 66669.90
Polar Surface Area: 70 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 53.8±5.0 dyne/cm
Molar Volume: 316.4±5.0 cm3

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