ChemSpider 2D Image | 1-(1-Benzothiophen-2-yl)-N-methyl-2-propanamine | C12H15NS

1-(1-Benzothiophen-2-yl)-N-methyl-2-propanamine

  • Molecular FormulaC12H15NS
  • Average mass205.319 Da
  • Monoisotopic mass205.092514 Da
  • ChemSpider ID26486341

More details:

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

1-(1-Benzothiophen-2-yl)-N-methyl-2-propanamin [German] [ACD/IUPAC Name]
1-(1-Benzothiophen-2-yl)-N-methyl-2-propanamine [ACD/IUPAC Name]
1-(1-Benzothiophén-2-yl)-N-méthyl-2-propanamine [French] [ACD/IUPAC Name]
Benzo[b]thiophene-2-ethanamine, N,α-dimethyl- [ACD/Index Name]
1199774-17-8 [RN]
MFCD13250019

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

Density: 1.1±0.1 g/cm3
Boiling Point: 321.2±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.3±3.0 kJ/mol
Flash Point: 148.1±20.9 °C
Index of Refraction: 1.606
Molar Refractivity: 64.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.01
ACD/LogD (pH 7.4): 1.17
ACD/BCF (pH 7.4): 1.14
ACD/KOC (pH 7.4): 7.33
Polar Surface Area: 40 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 188.1±3.0 cm3

Click to predict properties on the Chemicalize site


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