Chemical Properties of 1,2,3,5-Tetrathiane, 6-ethyl-4-pentyl

InChI

InChI=1S/C9H18S4/c1-3-5-6-7-9-10-8(4-2)11-13-12-9/h8-9H,3-7H2,1-2H3

InChI Key

MFMHIILUPVLZHI-UHFFFAOYSA-N

Formula

C9H18S4

SMILES

CCCCCC1SSSC(CC)S1

Molecular Weight¹

254.50

Other Names

• 4-ethyl-6-pentyl- 1,2,3,5-tetrathiane
• 4-Pentyl-6-ethyl-1,2,3,5-tetrathiane

• 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°	201.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-14.07	kJ/mol	Joback Calculated Property
ΔfusH°	26.60	kJ/mol	Joback Calculated Property
ΔvapH°	59.00	kJ/mol	Joback Calculated Property
log10WS	-6.21		Crippen Calculated Property
logPoct/wat	5.405		Crippen Calculated Property
McVol	192.210	ml/mol	McGowan Calculated Property
Pc	2673.54	kPa	Joback Calculated Property
Inp	[1760.20; 1818.00]
Inp	1760.20		NIST
Inp	1791.00		NIST
Inp	1818.00		NIST
Inp	1791.00		NIST
Inp	1818.00		NIST
Inp	1760.20		NIST
Tboil	611.52	K	Joback Calculated Property
Tc	862.08	K	Joback Calculated Property
Tfus	528.13	K	Joback Calculated Property
Vc	0.655	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[455.22; 546.11]	J/mol×K	[611.52; 862.08]
Cp,gas	455.22	J/mol×K	611.52	Joback Calculated Property
Cp,gas	473.22	J/mol×K	653.28	Joback Calculated Property
Cp,gas	490.01	J/mol×K	695.04	Joback Calculated Property
Cp,gas	505.65	J/mol×K	736.80	Joback Calculated Property
Cp,gas	520.18	J/mol×K	778.56	Joback Calculated Property
Cp,gas	533.65	J/mol×K	820.32	Joback Calculated Property
Cp,gas	546.11	J/mol×K	862.08	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2,3,5-Tetrathiane, 6-ethyl-4-pentyl.

Sources

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

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