ChemSpider 2D Image | (E)-1-[(1R,3aR)-1,3a-Dihydro-1-azulenyl]-N-hydroxymethanimine | C11H11NO

(E)-1-[(1R,3aR)-1,3a-Dihydro-1-azulenyl]-N-hydroxymethanimine

  • Molecular FormulaC11H11NO
  • Average mass173.211 Da
  • Monoisotopic mass173.084061 Da
  • ChemSpider ID30654688

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(E)-1-[(1R,3aR)-1,3a-Dihydro-1-azulenyl]-N-hydroxymethanimin [German] [ACD/IUPAC Name]
(E)-1-[(1R,3aR)-1,3a-Dihydro-1-azulenyl]-N-hydroxymethanimine [ACD/IUPAC Name]
(E)-1-[(1R,3aR)-1,3a-Dihydro-1-azulényl]-N-hydroxyméthanimine [French] [ACD/IUPAC Name]
1-Azulenecarboxaldehyde, 1,3a-dihydro-, oxime, (1R,3aR)- [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: 353.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 65.7±6.0 kJ/mol
Flash Point: 221.0±17.1 °C
Index of Refraction: 1.588
Molar Refractivity: 52.0±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.45
ACD/KOC (pH 5.5): 343.01
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.44
ACD/KOC (pH 7.4): 342.92
Polar Surface Area: 33 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 154.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement