Found 309 results

Search term: MF = 'C_{18}H_{12}N_{4}O'
ChemSpider 2D Image | 2-{[4-(Benzyloxy)phenyl]amino}-1,1,2-ethenetricarbonitrile | C18H12N4O

2-{[4-(Benzyloxy)phenyl]amino}-1,1,2-ethenetricarbonitrile

  • Molecular FormulaC18H12N4O
  • Average mass300.314 Da
  • Monoisotopic mass300.101105 Da
  • ChemSpider ID21627276

More details:

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

1,1,2-Ethenetricarbonitrile, 2-[[4-(phenylmethoxy)phenyl]amino]- [ACD/Index Name]
2-{[4-(Benzyloxy)phenyl]amino}-1,1,2-ethenetricarbonitrile [ACD/IUPAC Name]
2-{[4-(Benzyloxy)phényl]amino}-1,1,2-éthènetricarbonitrile [French] [ACD/IUPAC Name]
2-{[4-(Benzyloxy)phenyl]amino}-1,1,2-ethentricarbonitril [German] [ACD/IUPAC Name]
1-{[4-(benzyloxy)phenyl]amino}eth-1-ene-1,2,2-tricarbonitrile
1-{[4-(phenylmethoxy)phenyl]amino}ethene-1,2,2-tricarbonitrile

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

Density: 1.3±0.1 g/cm3
Boiling Point: 464.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.5±3.0 kJ/mol
Flash Point: 234.4±28.7 °C
Index of Refraction: 1.651
Molar Refractivity: 85.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.14
ACD/KOC (pH 5.5): 706.87
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 67.14
ACD/KOC (pH 7.4): 706.87
Polar Surface Area: 93 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 233.0±3.0 cm3

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