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Search term: YEBYSGXCCMHYAX-FXBPXSCXSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2,4-Dibromo-6-{(Z)-[(3-chloro-4-fluorophenyl)imino]methyl}phenol | C13H7Br2ClFNO

2,4-Dibromo-6-{(Z)-[(3-chloro-4-fluorophenyl)imino]methyl}phenol

  • Molecular FormulaC13H7Br2ClFNO
  • Average mass407.460 Da
  • Monoisotopic mass404.856689 Da
  • ChemSpider ID21539856
  • Double-bond stereo - Double-bond stereo


More details:






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

2,4-Dibrom-6-{(Z)-[(3-chlor-4-fluorphenyl)imino]methyl}phenol [German] [ACD/IUPAC Name]
2,4-Dibromo-6-{(Z)-[(3-chloro-4-fluorophenyl)imino]methyl}phenol [ACD/IUPAC Name]
2,4-Dibromo-6-{(Z)-[(3-chloro-4-fluorophényl)imino]méthyl}phénol [French] [ACD/IUPAC Name]
Phenol, 2,4-dibromo-6-[(Z)-[(3-chloro-4-fluorophenyl)imino]methyl]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 458.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 231.2±28.7 °C
Index of Refraction: 1.641
Molar Refractivity: 80.8±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.56
ACD/LogD (pH 5.5): 5.92
ACD/BCF (pH 5.5): 17197.64
ACD/KOC (pH 5.5): 34054.47
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 757.25
ACD/KOC (pH 7.4): 1499.49
Polar Surface Area: 33 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 224.2±7.0 cm3

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