Chemical Properties of 1,2,4,5-Tetrathiane, 3,6-diethyl-, trans- (CAS 934273-77-5)

InChI

InChI=1S/C6H12S4/c1-3-5-7-9-6(4-2)10-8-5/h5-6H,3-4H2,1-2H3/t5-,6-

InChI Key

WASBDGZBDGMWMT-IZLXSQMJSA-N

Formula

C6H12S4

SMILES

CCC1SSC(CC)SS1

Molecular Weight¹

212.42

CAS

934273-77-5

• 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.
• I : 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°	175.82	kJ/mol	Joback Calculated Property
ΔfH°gas	47.85	kJ/mol	Joback Calculated Property
ΔfusH°	18.83	kJ/mol	Joback Calculated Property
ΔvapH°	52.32	kJ/mol	Joback Calculated Property
log10WS	-4.96		Crippen Calculated Property
logPoct/wat	4.235		Crippen Calculated Property
McVol	149.940	ml/mol	McGowan Calculated Property
Pc	3690.97	kPa	Joback Calculated Property
Inp	[1613.20; 1613.20]
Inp	1613.20		NIST
Inp	1613.20		NIST
I	[1970.00; 1970.00]
I	1970.00		NIST
I	1970.00		NIST
Tboil	542.88	K	Joback Calculated Property
Tc	811.52	K	Joback Calculated Property
Tfus	494.32	K	Joback Calculated Property
Vc	0.487	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[313.29; 390.74]	J/mol×K	[542.88; 811.52]
Cp,gas	313.29	J/mol×K	542.88	Joback Calculated Property
Cp,gas	328.74	J/mol×K	587.65	Joback Calculated Property
Cp,gas	343.12	J/mol×K	632.43	Joback Calculated Property
Cp,gas	356.47	J/mol×K	677.20	Joback Calculated Property
Cp,gas	368.82	J/mol×K	721.97	Joback Calculated Property
Cp,gas	380.23	J/mol×K	766.75	Joback Calculated Property
Cp,gas	390.74	J/mol×K	811.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2,4,5-Tetrathiane, 3,6-diethyl-, trans-.

Sources

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

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