ChemSpider 2D Image | 1'-[2-(2,4-Dichlorophenoxy)propanoyl]-6-fluorospiro[chromene-2,3'-pyrrolidin]-4(3H)-one | C21H18Cl2FNO4

1'-[2-(2,4-Dichlorophenoxy)propanoyl]-6-fluorospiro[chromene-2,3'-pyrrolidin]-4(3H)-one

  • Molecular FormulaC21H18Cl2FNO4
  • Average mass438.276 Da
  • Monoisotopic mass437.059692 Da
  • ChemSpider ID67477380

More details:

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

1'-[2-(2,4-Dichlorophenoxy)propanoyl]-6-fluorospiro[chromene-2,3'-pyrrolidin]-4(3H)-one [ACD/IUPAC Name]
1'-[2-(2,4-Dichlorophénoxy)propanoyl]-6-fluorospiro[chromene-2,3'-pyrrolidin]-4(3H)-one [French] [ACD/IUPAC Name]
1'-[2-(2,4-Dichlorphenoxy)propanoyl]-6-fluorspiro[chromene-2,3'-pyrrolidin]-4(3H)-on [German] [ACD/IUPAC Name]
Spiro[2H-1-benzopyran-2,3'-pyrrolidin]-4(3H)-one, 1'-[2-(2,4-dichlorophenoxy)-1-oxopropyl]-6-fluoro- [ACD/Index 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: 623.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.3±3.0 kJ/mol
Flash Point: 330.9±31.5 °C
Index of Refraction: 1.630
Molar Refractivity: 106.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.69
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1565.10
ACD/KOC (pH 5.5): 6733.67
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1565.11
ACD/KOC (pH 7.4): 6733.68
Polar Surface Area: 56 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 59.6±5.0 dyne/cm
Molar Volume: 298.9±5.0 cm3

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