ChemSpider 2D Image | 3-(4-Chloro-3-methylphenoxy)-1-propanesulfonyl chloride | C10H12Cl2O3S

3-(4-Chloro-3-methylphenoxy)-1-propanesulfonyl chloride

  • Molecular FormulaC10H12Cl2O3S
  • Average mass283.172 Da
  • Monoisotopic mass281.988434 Da
  • ChemSpider ID25380964

More details:

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

1-Propanesulfonyl chloride, 3-(4-chloro-3-methylphenoxy)- [ACD/Index Name]
3-(4-Chlor-3-methylphenoxy)-1-propansulfonylchlorid [German] [ACD/IUPAC Name]
3-(4-Chloro-3-methylphenoxy)-1-propanesulfonyl chloride [ACD/IUPAC Name]
Chlorure de 3-(4-chloro-3-méthylphénoxy)-1-propanesulfonyle [French] [ACD/IUPAC Name]
1018340-71-0 [RN]
3-(4-chloro-3-methylphenoxy)propane-1-sulfonyl chloride
AKOS013518118
F9995-2243
MFCD10023014

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 396.0±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.1±3.0 kJ/mol
    Flash Point: 193.3±25.1 °C
    Index of Refraction: 1.545
    Molar Refractivity: 65.5±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.63
    ACD/LogD (pH 5.5): 3.38
    ACD/BCF (pH 5.5): 219.09
    ACD/KOC (pH 5.5): 1648.26
    ACD/LogD (pH 7.4): 3.38
    ACD/BCF (pH 7.4): 219.09
    ACD/KOC (pH 7.4): 1648.26
    Polar Surface Area: 52 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 45.8±3.0 dyne/cm
    Molar Volume: 207.1±3.0 cm3

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