ChemSpider 2D Image | N-[2-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)-4-methylpentyl]cyclopropanamine | C18H27NS

N-[2-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)-4-methylpentyl]cyclopropanamine

  • Molecular FormulaC18H27NS
  • Average mass289.479 Da
  • Monoisotopic mass289.186432 Da
  • ChemSpider ID52390007

More details:

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

Benzo[b]thiophene-2-propanamine, N-cyclopropyl-2,3-dihydro-β-(2-methylpropyl)- [ACD/Index Name]
N-[2-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)-4-methylpentyl]cyclopropanamin [German] [ACD/IUPAC Name]
N-[2-(2,3-Dihydro-1-benzothiophen-2-ylmethyl)-4-methylpentyl]cyclopropanamine [ACD/IUPAC Name]
N-[2-(2,3-Dihydro-1-benzothiophén-2-ylméthyl)-4-méthylpentyl]cyclopropanamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 403.4±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 197.8±22.9 °C
Index of Refraction: 1.572
Molar Refractivity: 89.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 5.31
ACD/KOC (pH 5.5): 15.80
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 64.27
ACD/KOC (pH 7.4): 191.21
Polar Surface Area: 37 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 272.8±5.0 cm3

Click to predict properties on the Chemicalize site


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