Chemical Properties of (2-Chloroethylthio)ethyl (vinylthio)ethyl ether

InChI

InChI=1S/C8H15ClOS2/c1-2-11-7-4-10-5-8-12-6-3-9/h2H,1,3-8H2

InChI Key

SRBUGBCUCZNCLI-UHFFFAOYSA-N

Formula

C8H15ClOS2

SMILES

C=CSCCOCCSCCCl

Molecular Weight¹

226.79

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	28.84	kJ/mol	Joback Calculated Property
ΔvapH°	76.31	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	2.852		Crippen Calculated Property
McVol	170.090	ml/mol	McGowan Calculated Property
Inp	[1661.00; 1714.10]
Inp	1661.00		NIST
Inp	1714.10		NIST
Inp	1661.00		NIST
Inp	1714.10		NIST
Tboil	565.37	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[235.20; 483.50]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			7.02160e+01
Coefficient B			6.76180e-01
Coefficient C			-2.63300e-04
Coefficient D			4.00000e-10
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	235.20	J/mol×K	273.00	Calculated Property
Cp,gas	276.50	J/mol×K	353.78	Calculated Property
Cp,gas	314.37	J/mol×K	434.56	Calculated Property
Cp,gas	348.80	J/mol×K	515.33	Calculated Property
Cp,gas	379.82	J/mol×K	596.11	Calculated Property
Cp,gas	407.40	J/mol×K	676.89	Calculated Property
Cp,gas	431.56	J/mol×K	757.67	Calculated Property
Cp,gas	452.29	J/mol×K	838.44	Calculated Property
Cp,gas	469.61	J/mol×K	919.22	Calculated Property
Cp,gas	483.50	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to (2-Chloroethylthio)ethyl (vinylthio)ethyl ether.

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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