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Search term: ARHWJJBPLJIHQP-AEGPPILISA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-[(1S,1aR,6aS)-1-Ethyl-1a,6-dihydrocyclopropa[a]inden-6a(1H)-yl]-1H-imidazole | C15H16N2

4-[(1S,1aR,6aS)-1-Ethyl-1a,6-dihydrocyclopropa[a]inden-6a(1H)-yl]-1H-imidazole

  • Molecular FormulaC15H16N2
  • Average mass224.301 Da
  • Monoisotopic mass224.131348 Da
  • ChemSpider ID26365423

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1H-Imidazole, 4-[(1S,1aR,6aS)-1-ethyl-1a,6-dihydrocycloprop[a]inden-6a(1H)-yl]- [ACD/Index Name]
4-[(1S,1aR,6aS)-1-Ethyl-1a,6-dihydrocyclopropa[a]inden-6a(1H)-yl]-1H-imidazol [German] [ACD/IUPAC Name]
4-[(1S,1aR,6aS)-1-Ethyl-1a,6-dihydrocyclopropa[a]inden-6a(1H)-yl]-1H-imidazole [ACD/IUPAC Name]
4-[(1S,1aR,6aS)-1-Éthyl-1a,6-dihydrocyclopropa[a]indén-6a(1H)-yl]-1H-imidazole [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 382.4±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.6±3.0 kJ/mol
Flash Point: 189.3±5.7 °C
Index of Refraction: 1.646
Molar Refractivity: 67.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 6.49
ACD/KOC (pH 5.5): 35.12
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 231.74
ACD/KOC (pH 7.4): 1253.27
Polar Surface Area: 29 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 185.3±3.0 cm3

Click to predict properties on the Chemicalize site


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