ChemSpider 2D Image | Methyl [(2-chlorophenyl)sulfonyl]acetate | C9H9ClO4S

Methyl [(2-chlorophenyl)sulfonyl]acetate

  • Molecular FormulaC9H9ClO4S
  • Average mass248.683 Da
  • Monoisotopic mass247.991013 Da
  • ChemSpider ID24302164

More details:

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

[(2-Chlorophényl)sulfonyl]acétate de méthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[(2-chlorophenyl)sulfonyl]-, methyl ester [ACD/Index Name]
Methyl [(2-chlorophenyl)sulfonyl]acetate [ACD/IUPAC Name]
Methyl-[(2-chlorphenyl)sulfonyl]acetat [German] [ACD/IUPAC Name]
(2-Chloro-benzenesulfonyl)-acetic acid methyl ester
[145449-37-2] [RN]
145449-37-2 [RN]
AGN-PC-0NKO6S
AKOS005745184
BBL006706
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 408.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.0±3.0 kJ/mol
    Flash Point: 200.6±28.7 °C
    Index of Refraction: 1.537
    Molar Refractivity: 56.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.55
    ACD/LogD (pH 5.5): 1.53
    ACD/BCF (pH 5.5): 8.58
    ACD/KOC (pH 5.5): 162.08
    ACD/LogD (pH 7.4): 1.53
    ACD/BCF (pH 7.4): 8.58
    ACD/KOC (pH 7.4): 162.08
    Polar Surface Area: 69 Å2
    Polarizability: 22.3±0.5 10-24cm3
    Surface Tension: 45.3±3.0 dyne/cm
    Molar Volume: 179.7±3.0 cm3

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