Chemical Properties of 4-Chlorobenzyl mercaptan (CAS 6258-66-8)

4-Chlorobenzyl mercaptan

InChI
InChI=1S/C7H7ClS/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2
InChI Key
GKQXPTHQTXCXEV-UHFFFAOYSA-N
Formula
C7H7ClS
SMILES
SCc1ccc(Cl)cc1
Molecular Weight1
158.65
CAS
6258-66-8
Other Names
  • p-Chlorobenzyl mercaptan
  • Benzenemethanethiol, 4-chloro-
  • p-chlorotoluene-«alpha»-thiol
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ω 0.4057 Relay (1.0) Calculated Property
Δf 128.30 kJ/mol Joback Calculated Property
Δfgas 27.14 kJ/mol Relay (1.0) Calculated Property
Δfus 15.78 kJ/mol Joback Calculated Property
Δvap 64.20 kJ/mol Relay (1.0) Calculated Property
IE 8.56 eV Relay (1.0) Calculated Property
log10WS -2.72 Relay (1.0) Calculated Property
logPoct/wat 2.770 Crippen Calculated Property
McVol 114.320 ml/mol McGowan Calculated Property
Pc 4178.49 kPa Joback Calculated Property
Tboil 500.36 K Relay (1.0) Calculated Property
Tc 732.83 K Relay (1.0) Calculated Property
Tfus 267.94 K Relay (1.0) Calculated Property
Vc 0.399 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [204.60; 258.20] J/mol×K [491.51; 738.23] Show Hide
Cp,gas 204.60 J/mol×K 491.51 Joback Calculated Property
Cp,gas 215.31 J/mol×K 532.63 Joback Calculated Property
Cp,gas 225.26 J/mol×K 573.75 Joback Calculated Property
Cp,gas 234.49 J/mol×K 614.87 Joback Calculated Property
Cp,gas 243.03 J/mol×K 655.99 Joback Calculated Property
Cp,gas 250.92 J/mol×K 697.11 Joback Calculated Property
Cp,gas 258.20 J/mol×K 738.23 Joback Calculated Property

Similar Compounds

2,4-Dichlorobenzyl mercaptan. 3,4-Dichlorobenzyl mercaptan. Benzenemethanethiol. 1,4-Benzenedimethanethiol. Benzenemethanethiol, 4-methyl-. 4-Fluorobenzyl mercaptan. m-Xylene-«alpha»,«alpha»'-dithiol. Benzene, 1-chloro-4-methyl-. 4-Methoxy-«alpha»-toluenethiol. Chlorbenside. Disulfide, bis(phenylmethyl). Benzyl methyl disulfide. Benzene, 1,1'-[sulfonylbis(methylene)]bis[4-chloro-. Benzene, 1-chloro-4-(chloromethyl)-. Thiocyanic acid, phenylmethyl ester.

Find more compounds similar to 4-Chlorobenzyl mercaptan.

Sources

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.