Chemical Properties of Benzene, (2-butenylthio)-, (Z)- (CAS 36195-55-8)

InChI

InChI=1S/C10H12S/c1-2-3-9-11-10-7-5-4-6-8-10/h2-8H,9H2,1H3/b3-2-

InChI Key

BNNLEMHAUPCSCL-IHWYPQMZSA-N

Formula

C10H12S

SMILES

CC=CCSc1ccccc1

Molecular Weight¹

164.27

CAS

36195-55-8

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[291.53; 366.11]	J/mol×K	[528.02; 765.56]
Cp,gas	291.53	J/mol×K	528.02	Joback Calculated Property
Cp,gas	306.39	J/mol×K	567.61	Joback Calculated Property
Cp,gas	320.20	J/mol×K	607.20	Joback Calculated Property
Cp,gas	333.02	J/mol×K	646.79	Joback Calculated Property
Cp,gas	344.91	J/mol×K	686.38	Joback Calculated Property
Cp,gas	355.92	J/mol×K	725.97	Joback Calculated Property
Cp,gas	366.11	J/mol×K	765.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (2-butenylthio)-, (Z)-.

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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