Found 4 results

Search term: AJLSNOAXXISZGO (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-[(5s,7s)-5,7-Dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl]-N,N-dimethylaniline | C18H27N3

4-[(5s,7s)-5,7-Dimethyl-1,3-diazatricyclo[3.3.1.13,7]dec-2-yl]-N,N-dimethylaniline

  • Molecular FormulaC18H27N3
  • Average mass285.427 Da
  • Monoisotopic mass285.220490 Da
  • ChemSpider ID21531740

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

4-[(5s,7s)-5,7-Dimethyl-1,3-diazatricyclo[3.3.1.13,7]dec-2-yl]-N,N-dimethylanilin [German] [ACD/IUPAC Name]
4-[(5s,7s)-5,7-Dimethyl-1,3-diazatricyclo[3.3.1.13,7]dec-2-yl]-N,N-dimethylaniline [ACD/IUPAC Name]
4-[(5s,7s)-5,7-Diméthyl-1,3-diazatricyclo[3.3.1.13,7]déc-2-yl]-N,N-diméthylaniline [French] [ACD/IUPAC Name]
Benzenamine, 4-(5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]dec-2-yl)-N,N-dimethyl- [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: 376.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 182.1±17.1 °C
Index of Refraction: 1.618
Molar Refractivity: 87.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 2.13
ACD/KOC (pH 5.5): 17.88
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 80.33
ACD/KOC (pH 7.4): 675.07
Polar Surface Area: 10 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 49.1±5.0 dyne/cm
Molar Volume: 250.8±5.0 cm3

Click to predict properties on the Chemicalize site


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