Found 417 results

Search term: MF = 'C_{25}H_{40}N_{2}O_{2}'
ChemSpider 2D Image | 3-(4-Isopropoxyphenyl)-N-isopropyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]propanamide | C25H40N2O2

3-(4-Isopropoxyphenyl)-N-isopropyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]propanamide

  • Molecular FormulaC25H40N2O2
  • Average mass400.597 Da
  • Monoisotopic mass400.308990 Da
  • ChemSpider ID58174910

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

3-(4-Isopropoxyphenyl)-N-isopropyl-N-[(1S,9aR)-octahydro-2H-chinolizin-1-ylmethyl]propanamid [German] [ACD/IUPAC Name]
3-(4-Isopropoxyphenyl)-N-isopropyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]propanamide [ACD/IUPAC Name]
3-(4-Isopropoxyphényl)-N-isopropyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylméthyl]propanamide [French] [ACD/IUPAC Name]
Benzenepropanamide, 4-(1-methylethoxy)-N-(1-methylethyl)-N-[[(1S,9aR)-octahydro-2H-quinolizin-1-yl]methyl]- [ACD/Index 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: 530.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 274.6±24.6 °C
Index of Refraction: 1.544
Molar Refractivity: 120.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.16
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 1.65
ACD/KOC (pH 5.5): 6.64
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 6.83
ACD/KOC (pH 7.4): 27.43
Polar Surface Area: 33 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 43.0±5.0 dyne/cm
Molar Volume: 380.5±5.0 cm3

Click to predict properties on the Chemicalize site


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