ChemSpider 2D Image | N-{[1-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)cyclobutyl]methyl}-2-methyl-2-propanamine | C18H27NS

N-{[1-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)cyclobutyl]methyl}-2-methyl-2-propanamine

  • Molecular FormulaC18H27NS
  • Average mass289.479 Da
  • Monoisotopic mass289.186432 Da
  • ChemSpider ID52390227

More details:

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

Cyclobutanemethanamine, 1-[(2,3-dihydrobenzo[b]thien-2-yl)methyl]-N-(1,1-dimethylethyl)- [ACD/Index Name]
N-{[1-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)cyclobutyl]methyl}-2-methyl-2-propanamin [German] [ACD/IUPAC Name]
N-{[1-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)cyclobutyl]methyl}-2-methyl-2-propanamine [ACD/IUPAC Name]
N-{[1-(2,3-Dihydro-1-benzothiophén-2-ylméthyl)cyclobutyl]méthyl}-2-méthyl-2-propanamine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 389.2±21.0 °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: 189.2±22.1 °C
Index of Refraction: 1.562
Molar Refractivity: 89.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 2.87
ACD/KOC (pH 5.5): 9.77
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 5.02
ACD/KOC (pH 7.4): 17.08
Polar Surface Area: 37 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 277.0±3.0 cm3

Click to predict properties on the Chemicalize site


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