Chemical Properties of 2,3,5,6-Tetrathiaheptane, 4-ethyl

InChI

InChI=1S/C5H10S4/c1-2-5-8-6-3-4-7-9-5/h5H,2-4H2,1H3

InChI Key

NUTMZWWGGCPEQF-UHFFFAOYSA-N

Formula

C5H10S4

SMILES

CCC1SSCCSS1

Molecular Weight¹

198.39

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.2559		Relay (1.0) Calculated Property
ΔfG°	163.01	kJ/mol	Joback Calculated Property
ΔfH°gas	0.47	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	13.07	kJ/mol	Joback Calculated Property
ΔvapH°	78.61	kJ/mol	Relay (1.0) Calculated Property
IE	8.25	eV	Relay (1.0) Calculated Property
log10WS	-2.55		Relay (1.0) Calculated Property
logPoct/wat	3.499		Crippen Calculated Property
McVol	135.850	ml/mol	McGowan Calculated Property
Pc	4492.23	kPa	Joback Calculated Property
Inp	[1452.00; 1462.00]
Inp	1462.00		NIST
Inp	1452.00		NIST
Inp	1462.00		NIST
Tboil	572.99	K	Relay (1.0) Calculated Property
Tc	797.97	K	Relay (1.0) Calculated Property
Tfus	310.90	K	Relay (1.0) Calculated Property
Vc	0.438	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[267.47; 340.50]	J/mol×K	[528.94; 815.07]
Cp,gas	267.47	J/mol×K	528.94	Joback Calculated Property
Cp,gas	282.32	J/mol×K	576.63	Joback Calculated Property
Cp,gas	296.05	J/mol×K	624.32	Joback Calculated Property
Cp,gas	308.70	J/mol×K	672.00	Joback Calculated Property
Cp,gas	320.29	J/mol×K	719.69	Joback Calculated Property
Cp,gas	330.88	J/mol×K	767.38	Joback Calculated Property
Cp,gas	340.50	J/mol×K	815.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,3,5,6-Tetrathiaheptane, 4-ethyl.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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