ChemSpider 2D Image | N-[4-(2-Methyl-2-propanyl)phenyl]-1-benzothiophen-3-amine | C18H19NS

N-[4-(2-Methyl-2-propanyl)phenyl]-1-benzothiophen-3-amine

  • Molecular FormulaC18H19NS
  • Average mass281.415 Da
  • Monoisotopic mass281.123810 Da
  • ChemSpider ID114876417

More details:

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

Benzo[b]thiophen-3-amine, N-[4-(1,1-dimethylethyl)phenyl]- [ACD/Index Name]
N-[4-(2-Methyl-2-propanyl)phenyl]-1-benzothiophen-3-amin [German] [ACD/IUPAC Name]
N-[4-(2-Methyl-2-propanyl)phenyl]-1-benzothiophen-3-amine [ACD/IUPAC Name]
N-[4-(2-Méthyl-2-propanyl)phényl]-1-benzothiophén-3-amine [French] [ACD/IUPAC Name]
2648198-92-7 [RN]
N-(4-(tert-Butyl)phenyl)benzo[b]thiophen-3-amine
N-(4-tert-butylphenyl)-1-benzothiophen-3-amine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 427.3±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 212.2±24.0 °C
Index of Refraction: 1.656
Molar Refractivity: 90.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.82
ACD/LogD (pH 5.5): 5.70
ACD/BCF (pH 5.5): 12452.08
ACD/KOC (pH 5.5): 29464.03
ACD/LogD (pH 7.4): 5.71
ACD/BCF (pH 7.4): 12823.07
ACD/KOC (pH 7.4): 30341.87
Polar Surface Area: 40 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 245.8±3.0 cm3

Click to predict properties on the Chemicalize site


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