Chemical Properties of 4-ethyl-3,5-dithiaheptane

InChI

InChI=1S/C7H16S2/c1-4-7(8-5-2)9-6-3/h7H,4-6H2,1-3H3

InChI Key

JZLJYGACXAEBDF-UHFFFAOYSA-N

Formula

C7H16S2

SMILES

CCSC(CC)SCC

Molecular Weight¹

164.33

Other Names

• 1,1-bis(ethylthio)propane

• 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°	71.86	kJ/mol	Joback Calculated Property
ΔfH°gas	-109.35	kJ/mol	Joback Calculated Property
ΔfusH°	18.62	kJ/mol	Joback Calculated Property
ΔvapH°	44.42	kJ/mol	Joback Calculated Property
log10WS	-3.13		Crippen Calculated Property
logPoct/wat	3.229		Crippen Calculated Property
McVol	142.190	ml/mol	McGowan Calculated Property
Pc	2928.17	kPa	Joback Calculated Property
Inp	[1165.00; 1168.00]
Inp	1165.00		NIST
Inp	1168.00		NIST
Inp	1168.00		NIST
Inp	1165.00		NIST
Tboil	496.68	K	Joback Calculated Property
Tc	710.61	K	Joback Calculated Property
Tfus	222.45	K	Joback Calculated Property
Vc	0.529	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[296.60; 370.16]	J/mol×K	[496.68; 710.61]
Cp,gas	296.60	J/mol×K	496.68	Joback Calculated Property
Cp,gas	310.45	J/mol×K	532.33	Joback Calculated Property
Cp,gas	323.66	J/mol×K	567.99	Joback Calculated Property
Cp,gas	336.24	J/mol×K	603.64	Joback Calculated Property
Cp,gas	348.17	J/mol×K	639.30	Joback Calculated Property
Cp,gas	359.48	J/mol×K	674.95	Joback Calculated Property
Cp,gas	370.16	J/mol×K	710.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-ethyl-3,5-dithiaheptane.

Sources

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

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