ChemSpider 2D Image | Perillartine | C10H15NO

Perillartine

  • Molecular FormulaC10H15NO
  • Average mass165.232 Da
  • Monoisotopic mass165.115356 Da
  • ChemSpider ID24743040
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(E)-N-Hydroxy-1-[(4S)-4-isopropenyl-1-cyclohexen-1-yl]methanimin [German] [ACD/IUPAC Name]
(E)-N-Hydroxy-1-[(4S)-4-isopropenyl-1-cyclohexen-1-yl]methanimine [ACD/IUPAC Name]
(E)-N-Hydroxy-1-[(4S)-4-isopropényl-1-cyclohexén-1-yl]méthanimine [French] [ACD/IUPAC Name]
(S)-Perillartine
1-Cyclohexene-1-carboxaldehyde, 4-(1-methylethenyl)-, oxime, (4S)- [ACD/Index Name]
Perillartine [Wiki]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 271.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 59.2±6.0 kJ/mol
Flash Point: 158.3±16.6 °C
Index of Refraction: 1.513
Molar Refractivity: 49.6±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 60.05
ACD/KOC (pH 5.5): 652.65
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 60.05
ACD/KOC (pH 7.4): 652.60
Polar Surface Area: 33 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 33.0±7.0 dyne/cm
Molar Volume: 165.2±7.0 cm3

Click to predict properties on the Chemicalize site






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