ChemSpider 2D Image | 1-(3,4-Dichlorophenyl)-1-hexanone | C12H14Cl2O

1-(3,4-Dichlorophenyl)-1-hexanone

  • Molecular FormulaC12H14Cl2O
  • Average mass245.145 Da
  • Monoisotopic mass244.042175 Da
  • ChemSpider ID15301583

More details:

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

1-(3,4-Dichlorophenyl)-1-hexanone [ACD/IUPAC Name]
1-(3,4-Dichlorophényl)-1-hexanone [French] [ACD/IUPAC Name]
1-(3,4-Dichlorphenyl)-1-hexanon [German] [ACD/IUPAC Name]
1-Hexanone, 1-(3,4-dichlorophenyl)- [ACD/Index Name]
1-(3,4-dichlorophenyl)hexan-1-one
1-(3,4-dichloro-phenyl)-hexan-1-one
3,4-dichlorovalerophenone
68329-74-8 [RN]
atoms 15 bonds 15
MFCD11641910

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 345.0±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.9±3.0 kJ/mol
    Flash Point: 145.6±24.3 °C
    Index of Refraction: 1.525
    Molar Refractivity: 64.6±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 5.20
    ACD/LogD (pH 5.5): 5.32
    ACD/BCF (pH 5.5): 6484.43
    ACD/KOC (pH 5.5): 18626.41
    ACD/LogD (pH 7.4): 5.32
    ACD/BCF (pH 7.4): 6484.43
    ACD/KOC (pH 7.4): 18626.41
    Polar Surface Area: 17 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 37.9±3.0 dyne/cm
    Molar Volume: 210.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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