Found 2 results

Search term: MTWMIBBVUBOTRI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5-Ethoxy-2,8-dimethoxy-4,5-dihydro-3-azocinecarbonitrile | C12H16N2O3

5-Ethoxy-2,8-dimethoxy-4,5-dihydro-3-azocinecarbonitrile

  • Molecular FormulaC12H16N2O3
  • Average mass236.267 Da
  • Monoisotopic mass236.116089 Da
  • ChemSpider ID57538899

More details:

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

3-Azocinecarbonitrile, 5-ethoxy-4,5-dihydro-2,8-dimethoxy- [ACD/Index Name]
5-Ethoxy-2,8-dimethoxy-4,5-dihydro-3-azocincarbonitril [German] [ACD/IUPAC Name]
5-Ethoxy-2,8-dimethoxy-4,5-dihydro-3-azocinecarbonitrile [ACD/IUPAC Name]
5-Éthoxy-2,8-diméthoxy-4,5-dihydro-3-azocinecarbonitrile [French] [ACD/IUPAC Name]
501955-73-3 [RN]
5-Ethoxy-2,8-dimethoxy-4,5-dihydroazocine-3-carbonitrile

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

Density: 1.1±0.1 g/cm3
Boiling Point: 381.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 184.6±30.7 °C
Index of Refraction: 1.504
Molar Refractivity: 63.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.39
ACD/KOC (pH 5.5): 198.51
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.39
ACD/KOC (pH 7.4): 198.51
Polar Surface Area: 64 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 35.0±7.0 dyne/cm
Molar Volume: 215.7±7.0 cm3

Click to predict properties on the Chemicalize site


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