Chemical Properties of 3,4-Dichlorophenyl methanesulfonate (CAS 116401-62-8)

3,4-Dichlorophenyl methanesulfonate

InChI
InChI=1S/C7H6Cl2O3S/c1-13(10,11)12-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChI Key
VSSFDMFYPXHKHF-UHFFFAOYSA-N
Formula
C7H6Cl2O3S
SMILES
CS(=O)(=O)Oc1ccc(Cl)c(Cl)c1
Molecular Weight1
241.09
CAS
116401-62-8
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Physical Properties

Property Value Unit Source
ΔfusH° 28.11 kJ/mol Joback Calculated Property
log10WS -3.80 Relay (1.0) Calculated Property
logPoct/wat 2.332 Crippen Calculated Property
McVol 144.170 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [279.02; 330.11] J/mol×K [541.26; 759.41] Show Hide
Cp,gas 279.02 J/mol×K 541.26 Joback Calculated Property
Cp,gas 288.97 J/mol×K 577.62 Joback Calculated Property
Cp,gas 298.36 J/mol×K 613.98 Joback Calculated Property
Cp,gas 307.18 J/mol×K 650.34 Joback Calculated Property
Cp,gas 315.43 J/mol×K 686.69 Joback Calculated Property
Cp,gas 323.07 J/mol×K 723.05 Joback Calculated Property
Cp,gas 330.11 J/mol×K 759.41 Joback Calculated Property

Similar Compounds

Methylsulfonic acid, 2,4,5-trichlorophenyl ester. Methylsulfonic acid, 2,3,4,6-tetrachlorophenyl ester. 3,4-Dichlorophenyl-4-chlorobenzene sulfonate. Methylsulfonic acid, 4-biphenyl ester. Phenol, 2,4-dichloro-, benzenesulfonate. 3,4-Dichloroanisole. 3,4-DICHLOROPHENOL. Ovex. 3,4-Dichlorophenol, trimethylsilyl ether. Benzenesulfonic acid, 4-chlorophenyl ester. 3,4-Dichlorophenol, trifluoroacetate. 4-Chlorobenzoic acid, 3,4-dichlorophenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. Trichloroacetic acid, 3,4-dichlorophenyl ester. 3-Chlorobenzoic acid, 3,4-dichlorophenyl ester.

Find more compounds similar to 3,4-Dichlorophenyl methanesulfonate.

Sources

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