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Search term: ONNIREQQWIIWFA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2Z)-2-[4-(4-Chlorophenoxy)benzylidene]-1-benzofuran-3(2H)-one | C21H13ClO3

(2Z)-2-[4-(4-Chlorophenoxy)benzylidene]-1-benzofuran-3(2H)-one

  • Molecular FormulaC21H13ClO3
  • Average mass348.779 Da
  • Monoisotopic mass348.055328 Da
  • ChemSpider ID34250750

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-[4-(4-Chlorophenoxy)benzylidene]-1-benzofuran-3(2H)-one [ACD/IUPAC Name]
(2Z)-2-[4-(4-Chlorophénoxy)benzylidène]-1-benzofuran-3(2H)-one [French] [ACD/IUPAC Name]
(2Z)-2-[4-(4-Chlorphenoxy)benzyliden]-1-benzofuran-3(2H)-on [German] [ACD/IUPAC Name]
3(2H)-Benzofuranone, 2-[[4-(4-chlorophenoxy)phenyl]methylene]-, (2Z)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 512.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 197.4±29.1 °C
Index of Refraction: 1.686
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8046.19
ACD/KOC (pH 5.5): 21737.63
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8046.19
ACD/KOC (pH 7.4): 21737.63
Polar Surface Area: 36 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 256.4±3.0 cm3

Click to predict properties on the Chemicalize site


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