Chemical Properties of 3-Methyl-1,2,4-trithiane

InChI

InChI=1S/C4H8S3/c1-4-5-2-3-6-7-4/h4H,2-3H2,1H3

InChI Key

UXPUEXDAOSQIQS-UHFFFAOYSA-N

Formula

C4H8S3

SMILES

CC1SCCSS1

Molecular Weight¹

152.30

Other Names

• 1,2,4-Trithiane, 3-methyl

• 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.
• 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
ω	0.2204		Relay (... Calculated Property
ΔfG°	126.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-2.18	kJ/mol	Relay (... Calculated Property
ΔfusH°	8.92	kJ/mol	Joback Calculated Property
ΔvapH°	65.81	kJ/mol	Relay (... Calculated Property
IE	8.33	eV	Relay (... Calculated Property
log10WS	-1.52		Relay (... Calculated Property
logPoct/wat	2.461		Crippen Calculated Property
McVol	105.410	ml/mol	McGowan Calculated Property
Pc	4994.44	kPa	Joback Calculated Property
Inp	[1214.00; 1290.00]
Inp	1266.00		NIST
Inp	1290.00		NIST
Inp	1287.00		NIST
Inp	1254.00		NIST
Inp	1253.00		NIST
Inp	1214.00		NIST
Inp	1243.00		NIST
Inp	1243.00		NIST
I	[1852.00; 1862.00]
I	1852.00		NIST
I	1862.00		NIST
Tboil	504.55	K	Relay (... Calculated Property
Tc	745.35	K	Relay (... Calculated Property
Tfus	288.77	K	Relay (... Calculated Property
Vc	0.348	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[186.98; 249.78]	J/mol×K	[453.96; 718.89]
Cp,gas	186.98	J/mol×K	453.96	Joback Calculated Property
Cp,gas	199.50	J/mol×K	498.11	Joback Calculated Property
Cp,gas	211.14	J/mol×K	542.27	Joback Calculated Property
Cp,gas	221.95	J/mol×K	586.42	Joback Calculated Property
Cp,gas	231.97	J/mol×K	630.58	Joback Calculated Property
Cp,gas	241.23	J/mol×K	674.73	Joback Calculated Property
Cp,gas	249.78	J/mol×K	718.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Methyl-1,2,4-trithiane.

Sources

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

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