Chemical Properties of Benzenesulfonic acid, 4-chlorophenyl ester

InChI

InChI=1S/C12H9ClO3S/c13-10-6-8-11(9-7-10)16-17(14,15)12-4-2-1-3-5-12/h1-9H

InChI Key

SPJOZZSIXXJYBT-UHFFFAOYSA-N

Formula

C12H9ClO3S

SMILES

O=S(=O)(Oc1ccc(Cl)cc1)c1ccccc1

Molecular Weight¹

268.72

Other Names

• Benzenesulfonic acid, p-chlorophenyl ester
• p-Chlorophenyl benzenesulfonate
• p-Chlorophenyl benzenesulphonate
• Aracid
• CPBS
• Fenson
• Fensone
• Murvesco
• PCBS
• PCI
• PCPBS
• 4-Chlorophenyl benzenesulfonate
• 4-Chlorophenyl benzenesulphonate
• 928
• (4-Chloor-fenyl)-benzeen-sulfonaat
• (4-Chlor-phenyl)-benzolsulfonat
• (4-Cloro-fenil)-benzol-solfonato
• p-Chlorofenylester kyseliny benzensulfonove
• Ent 4,585
• Fenizon
• GC-928
• Benzenesulfonate de 4-chlorophenyle
• NSC 406662
• Ovicide Seppic
• Phenizon

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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	[409.52; 475.86]	J/mol×K	[640.13; 879.30]
Cp,gas	409.52	J/mol×K	640.13	Joback Calculated Property
Cp,gas	423.44	J/mol×K	679.99	Joback Calculated Property
Cp,gas	436.19	J/mol×K	719.85	Joback Calculated Property
Cp,gas	447.79	J/mol×K	759.71	Joback Calculated Property
Cp,gas	458.26	J/mol×K	799.57	Joback Calculated Property
Cp,gas	467.61	J/mol×K	839.44	Joback Calculated Property
Cp,gas	475.86	J/mol×K	879.30	Joback Calculated Property
ΔfusH	[21.44; 21.44]	kJ/mol	[332.20; 332.20]
ΔfusH	21.44	kJ/mol	332.20	NIST
ΔfusH	21.44	kJ/mol	332.20	NIST

Similar Compounds

Find more compounds similar to Benzenesulfonic acid, 4-chlorophenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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