Chemical Properties of Benzene, 1,2-bis-(methylthio)ethyl

InChI

InChI=1S/C10H14S2/c1-11-8-10(12-2)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3

InChI Key

ILDMWBMAZPQGPE-UHFFFAOYSA-N

Formula

C10H14S2

SMILES

CSCC(SC)c1ccccc1

Molecular Weight¹

198.35

• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	209.53	kJ/mol	Joback Calculated Property
ΔfH°gas	65.26	kJ/mol	Joback Calculated Property
ΔfusH°	20.43	kJ/mol	Joback Calculated Property
ΔvapH°	53.38	kJ/mol	Joback Calculated Property
log10WS	-3.34		Crippen Calculated Property
logPoct/wat	3.454		Crippen Calculated Property
McVol	160.700	ml/mol	McGowan Calculated Property
Pc	3069.34	kPa	Joback Calculated Property
Inp	[1545.00; 1545.00]
Inp	1545.00		NIST
Inp	1545.00		NIST
Tboil	592.00	K	Joback Calculated Property
Tc	844.18	K	Joback Calculated Property
Tfus	282.68	K	Joback Calculated Property
Vc	0.590	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[362.14; 440.28]	J/mol×K	[592.00; 844.18]
Cp,gas	362.14	J/mol×K	592.00	Joback Calculated Property
Cp,gas	377.93	J/mol×K	634.03	Joback Calculated Property
Cp,gas	392.57	J/mol×K	676.06	Joback Calculated Property
Cp,gas	406.09	J/mol×K	718.09	Joback Calculated Property
Cp,gas	418.52	J/mol×K	760.12	Joback Calculated Property
Cp,gas	429.91	J/mol×K	802.15	Joback Calculated Property
Cp,gas	440.28	J/mol×K	844.18	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1,2-bis-(methylthio)ethyl.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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