Chemical Properties of p-Methylsulfonylbenzyl chloride

p-Methylsulfonylbenzyl chloride

InChI
InChI=1S/C8H9ClO2S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-5H,6H2,1H3
InChI Key
LXPRVXKHIXWBJZ-UHFFFAOYSA-N
Formula
C8H9ClO2S
SMILES
CS(=O)(=O)c1ccc(CCl)cc1
Molecular Weight1
204.68
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Physical Properties

Property Value Unit Source
Δfgas -326.94 kJ/mol Relay (1.0) Calculated Property
Δfus 25.70 kJ/mol Joback Calculated Property
Δvap 99.00 kJ/mol Relay (1.0) Calculated Property
IE 9.46 eV Relay (1.0) Calculated Property
log10WS -3.13 Relay (1.0) Calculated Property
logPoct/wat 1.829 Crippen Calculated Property
McVol 140.150 ml/mol McGowan Calculated Property
Tboil 597.33 K Relay (1.0) Calculated Property
Tfus 391.48 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [276.08; 339.30] J/mol×K [499.51; 710.37] Show Hide
Cp,gas 276.08 J/mol×K 499.51 Joback Calculated Property
Cp,gas 288.33 J/mol×K 534.65 Joback Calculated Property
Cp,gas 299.88 J/mol×K 569.80 Joback Calculated Property
Cp,gas 310.75 J/mol×K 604.94 Joback Calculated Property
Cp,gas 320.94 J/mol×K 640.08 Joback Calculated Property
Cp,gas 330.45 J/mol×K 675.23 Joback Calculated Property
Cp,gas 339.30 J/mol×K 710.37 Joback Calculated Property

Similar Compounds

Methyl-p-tolyl sulfone. Methyl 4-methylphenylsulfoxide. 4-(methylsulfonyl)benzaldehyde. p-Toluenesulfonylacetonitrile. 1-Methyl-4-(2-propynyl-sulphonyl)benzene. Benzonitrile, 4-(methylsulfonyl)-. Benzene, 1-(ethenylsulfonyl)-4-methyl-. 2-Propanone, 1-[(4-methylphenyl)sulfonyl]-. p-Tolyl propadienyl sulphone. 1-Methyl-4-(1-propynyl-sulphonyl)benzene. (E)-1-Methyl-4-(1-propenyl-sulphonyl)-benzene. 1-Methyl-4-(2-methyl-1-propenylsulphonyl)-benzene. 4-CH3SO2-C6H4-COOCH3. 2-Butenyl p-tolyl sulphone. 2-Methyl-2-propenyl p-tolyl sulphone.

Find more compounds similar to p-Methylsulfonylbenzyl chloride.

Sources

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