ChemSpider 2D Image | 1-(2,4,6-Cycloheptatrien-1-yl)-N-methyl-2-propanamine | C11H17N

1-(2,4,6-Cycloheptatrien-1-yl)-N-methyl-2-propanamine

  • Molecular FormulaC11H17N
  • Average mass163.259 Da
  • Monoisotopic mass163.136093 Da
  • ChemSpider ID60612824

More details:






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

1-(2,4,6-Cycloheptatrien-1-yl)-N-methyl-2-propanamin [German] [ACD/IUPAC Name]
1-(2,4,6-Cycloheptatrien-1-yl)-N-methyl-2-propanamine [ACD/IUPAC Name]
1-(2,4,6-Cycloheptatrién-1-yl)-N-méthyl-2-propanamine [French] [ACD/IUPAC Name]
2,4,6-Cycloheptatriene-1-ethanamine, N,α-dimethyl- [ACD/Index Name]
408507-51-7 [RN]
MFCD20675389

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 237.8±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 97.8±10.9 °C
Index of Refraction: 1.491
Molar Refractivity: 53.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.18
Polar Surface Area: 12 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 183.9±3.0 cm3

Click to predict properties on the Chemicalize site






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