ChemSpider 2D Image | N-[(1S,2S,6R)-2-Ethyl-6-methylcyclohexyl]-4,5-dihydro-1,3-oxazol-2-amine | C12H22N2O

N-[(1S,2S,6R)-2-Ethyl-6-methylcyclohexyl]-4,5-dihydro-1,3-oxazol-2-amine

  • Molecular FormulaC12H22N2O
  • Average mass210.316 Da
  • Monoisotopic mass210.173218 Da
  • ChemSpider ID23220928

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2-Oxazolamine, N-[(1S,2S,6R)-2-ethyl-6-methylcyclohexyl]-4,5-dihydro- [ACD/Index Name]
N-[(1S,2S,6R)-2-Ethyl-6-methylcyclohexyl]-4,5-dihydro-1,3-oxazol-2-amin [German] [ACD/IUPAC Name]
N-[(1S,2S,6R)-2-Ethyl-6-methylcyclohexyl]-4,5-dihydro-1,3-oxazol-2-amine [ACD/IUPAC Name]
N-[(1S,2S,6R)-2-Éthyl-6-méthylcyclohexyl]-4,5-dihydro-1,3-oxazol-2-amine [French] [ACD/IUPAC Name]
(2-Ethyl-6-methyl-cyclohexyl)-oxazolidin-2-ylidene-amine
BAY-A-6781

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

Density: 1.1±0.1 g/cm3
Boiling Point: 357.1±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.2±3.0 kJ/mol
Flash Point: 169.8±18.7 °C
Index of Refraction: 1.568
Molar Refractivity: 59.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 1.68
ACD/KOC (pH 5.5): 14.85
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 28.13
ACD/KOC (pH 7.4): 247.94
Polar Surface Area: 34 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 37.2±7.0 dyne/cm
Molar Volume: 182.9±7.0 cm3

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