Chemical Properties of 2-Propenyl 2,3-bis-(methylthio)propyl ether

InChI

InChI=1S/C8H16OS2/c1-4-5-9-6-8(11-3)7-10-2/h4,8H,1,5-7H2,2-3H3

InChI Key

XVCHWYZDFBUKMR-UHFFFAOYSA-N

Formula

C8H16OS2

SMILES

C=CCOCC(CSC)SC

Molecular Weight¹

192.34

• 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°	63.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-136.78	kJ/mol	Joback Calculated Property
ΔfusH°	21.12	kJ/mol	Joback Calculated Property
ΔvapH°	48.39	kJ/mol	Joback Calculated Property
log10WS	-1.99		Crippen Calculated Property
logPoct/wat	2.284		Crippen Calculated Property
McVol	157.850	ml/mol	McGowan Calculated Property
Pc	2715.50	kPa	Joback Calculated Property
Inp	[1380.00; 1380.00]
Inp	1380.00		NIST
Inp	1380.00		NIST
Tboil	538.66	K	Joback Calculated Property
Tc	751.59	K	Joback Calculated Property
Tfus	254.19	K	Joback Calculated Property
Vc	0.585	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[346.58; 420.32]	J/mol×K	[538.66; 751.59]
Cp,gas	346.58	J/mol×K	538.66	Joback Calculated Property
Cp,gas	360.53	J/mol×K	574.15	Joback Calculated Property
Cp,gas	373.82	J/mol×K	609.64	Joback Calculated Property
Cp,gas	386.44	J/mol×K	645.12	Joback Calculated Property
Cp,gas	398.40	J/mol×K	680.61	Joback Calculated Property
Cp,gas	409.70	J/mol×K	716.10	Joback Calculated Property
Cp,gas	420.32	J/mol×K	751.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Propenyl 2,3-bis-(methylthio)propyl ether.

Sources

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

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