ChemSpider 2D Image | 4-Chloro-2-{[(2-chloro-4-fluorobenzyl)amino]methyl}phenol | C14H12Cl2FNO

4-Chloro-2-{[(2-chloro-4-fluorobenzyl)amino]methyl}phenol

  • Molecular FormulaC14H12Cl2FNO
  • Average mass300.156 Da
  • Monoisotopic mass299.027985 Da
  • ChemSpider ID24594078

More details:






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

4-Chlor-2-{[(2-chlor-4-fluorbenzyl)amino]methyl}phenol [German] [ACD/IUPAC Name]
4-Chloro-2-{[(2-chloro-4-fluorobenzyl)amino]methyl}phenol [ACD/IUPAC Name]
4-Chloro-2-{[(2-chloro-4-fluorobenzyl)amino]méthyl}phénol [French] [ACD/IUPAC Name]
Phenol, 4-chloro-2-[[[(2-chloro-4-fluorophenyl)methyl]amino]methyl]- [ACD/Index Name]
[1223886-70-1] [RN]
1223886-70-1 [RN]
4-CHLORO-2-({[(2-CHLORO-4-FLUOROPHENYL)METHYL]AMINO}METHYL)PHENOL
4-Chloro-2-[(2-chloro-4-fluoro-benzylamino)-methyl]-phenol
4-chloro-2-[[(2-chloro-4-fluorophenyl)methylamino]methyl]phenol
MFCD18170390

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 407.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.5±3.0 kJ/mol
    Flash Point: 200.2±27.3 °C
    Index of Refraction: 1.609
    Molar Refractivity: 75.6±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.83
    ACD/LogD (pH 5.5): 3.07
    ACD/BCF (pH 5.5): 71.73
    ACD/KOC (pH 5.5): 377.79
    ACD/LogD (pH 7.4): 4.05
    ACD/BCF (pH 7.4): 677.12
    ACD/KOC (pH 7.4): 3566.15
    Polar Surface Area: 32 Å2
    Polarizability: 30.0±0.5 10-24cm3
    Surface Tension: 49.1±3.0 dyne/cm
    Molar Volume: 218.3±3.0 cm3

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