Found 74 results

Search term: MF = 'C_{18}H_{11}F_{2}NO_{4}'
ChemSpider 2D Image | [(4Z)-4-(3,4-Difluorobenzylidene)-1,3-dioxo-3,4-dihydro-2(1H)-isoquinolinyl]acetic acid | C18H11F2NO4

[(4Z)-4-(3,4-Difluorobenzylidene)-1,3-dioxo-3,4-dihydro-2(1H)-isoquinolinyl]acetic acid

  • Molecular FormulaC18H11F2NO4
  • Average mass343.281 Da
  • Monoisotopic mass343.065613 Da
  • ChemSpider ID22844575

  • Double-bond stereo - Double-bond stereo

More details:

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

[(4Z)-4-(3,4-Difluorbenzyliden)-1,3-dioxo-3,4-dihydro-2(1H)-isochinolinyl]essigsäure [German] [ACD/IUPAC Name]
[(4Z)-4-(3,4-Difluorobenzylidene)-1,3-dioxo-3,4-dihydro-2(1H)-isoquinolinyl]acetic acid [ACD/IUPAC Name]
2(1H)-Isoquinolineacetic acid, 4-[(3,4-difluorophenyl)methylene]-3,4-dihydro-1,3-dioxo-, (4Z)- [ACD/Index Name]
Acide [(4Z)-4-(3,4-difluorobenzylidène)-1,3-dioxo-3,4-dihydro-2(1H)-isoquinoléinyl]acétique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 572.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 299.9±30.1 °C
Index of Refraction: 1.653
Molar Refractivity: 83.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.70
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 62.9±3.0 dyne/cm
Molar Volume: 228.7±3.0 cm3

Click to predict properties on the Chemicalize site


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