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

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

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[204.60; 258.20]	J/mol×K	[491.51; 738.23]
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

Find more compounds similar to 4-Chlorobenzyl mercaptan.

Sources

• 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.