ChemSpider 2D Image | (2E)-2-({2-[(E)-(Hydroxyimino)methyl]phenoxy}methyl)-3-(4-methylphenyl)acrylonitrile | C18H16N2O2

(2E)-2-({2-[(E)-(Hydroxyimino)methyl]phenoxy}methyl)-3-(4-methylphenyl)acrylonitrile

  • Molecular FormulaC18H16N2O2
  • Average mass292.332 Da
  • Monoisotopic mass292.121185 Da
  • ChemSpider ID30657467

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-({2-[(E)-(Hydroxyimino)methyl]phenoxy}methyl)-3-(4-methylphenyl)acrylonitril [German] [ACD/IUPAC Name]
(2E)-2-({2-[(E)-(Hydroxyimino)methyl]phenoxy}methyl)-3-(4-methylphenyl)acrylonitrile [ACD/IUPAC Name]
(2E)-2-({2-[(E)-(Hydroxyimino)méthyl]phénoxy}méthyl)-3-(4-méthylphényl)acrylonitrile [French] [ACD/IUPAC Name]
2-Propenenitrile, 2-[[2-[(E)-(hydroxyimino)methyl]phenoxy]methyl]-3-(4-methylphenyl)-, (2E)- [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: 522.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 269.8±30.1 °C
Index of Refraction: 1.562
Molar Refractivity: 87.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 821.74
ACD/KOC (pH 5.5): 4245.87
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 821.30
ACD/KOC (pH 7.4): 4243.61
Polar Surface Area: 66 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 41.3±7.0 dyne/cm
Molar Volume: 269.7±7.0 cm3

Click to predict properties on the Chemicalize site


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