ChemSpider 2D Image | 2-(4-Isopropylphenyl)-4,6-dimethyl-1,3-benzothiazole | C18H19NS

2-(4-Isopropylphenyl)-4,6-dimethyl-1,3-benzothiazole

  • Molecular FormulaC18H19NS
  • Average mass281.415 Da
  • Monoisotopic mass281.123810 Da
  • ChemSpider ID32834377

More details:

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

2-(4-Isopropylphenyl)-4,6-dimethyl-1,3-benzothiazol [German] [ACD/IUPAC Name]
2-(4-Isopropylphenyl)-4,6-dimethyl-1,3-benzothiazole [ACD/IUPAC Name]
2-(4-Isopropylphényl)-4,6-diméthyl-1,3-benzothiazole [French] [ACD/IUPAC Name]
Benzothiazole, 4,6-dimethyl-2-[4-(1-methylethyl)phenyl]- [ACD/Index Name]
2-(4-Isopropyl-phenyl)-4,6-dimethyl-benzothiazole

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

Density: 1.1±0.1 g/cm3
Boiling Point: 411.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 195.9±20.4 °C
Index of Refraction: 1.618
Molar Refractivity: 89.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.52
ACD/LogD (pH 5.5): 5.61
ACD/BCF (pH 5.5): 10895.03
ACD/KOC (pH 5.5): 27002.45
ACD/LogD (pH 7.4): 5.61
ACD/BCF (pH 7.4): 10898.02
ACD/KOC (pH 7.4): 27009.86
Polar Surface Area: 41 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 254.2±3.0 cm3

Click to predict properties on the Chemicalize site


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