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Search term: IVEMIOQXGXITPA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | {2-[(2-Cyanobenzyl)oxy]benzylidene}malononitrile | C18H11N3O

{2-[(2-Cyanobenzyl)oxy]benzylidene}malononitrile

  • Molecular FormulaC18H11N3O
  • Average mass285.299 Da
  • Monoisotopic mass285.090210 Da
  • ChemSpider ID22199963

More details:

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

{2-[(2-Cyanbenzyl)oxy]benzyliden}malononitril [German] [ACD/IUPAC Name]
{2-[(2-Cyanobenzyl)oxy]benzylidene}malononitrile [ACD/IUPAC Name]
{2-[(2-Cyanobenzyl)oxy]benzylidène}malononitrile [French] [ACD/IUPAC Name]
Propanedinitrile, 2-[[2-[(2-cyanophenyl)methoxy]phenyl]methylene]- [ACD/Index Name]
2-({2-[(2-CYANOPHENYL)METHOXY]PHENYL}METHYLIDENE)PROPANEDINITRILE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 497.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.5±3.0 kJ/mol
Flash Point: 197.5±20.2 °C
Index of Refraction: 1.623
Molar Refractivity: 80.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 3.14
ACD/BCF (pH 5.5): 144.67
ACD/KOC (pH 5.5): 1224.64
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 144.67
ACD/KOC (pH 7.4): 1224.64
Polar Surface Area: 81 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 228.1±5.0 cm3

Click to predict properties on the Chemicalize site


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