Chemical Properties of 1-(Ethylthiomethyl)propene

InChI

InChI=1S/C6H12S/c1-3-5-6-7-4-2/h3,5H,4,6H2,1-2H3/b5-3+

InChI Key

BHFZHOGCQAPTLZ-HWKANZROSA-N

Formula

C6H12S

SMILES

CC=CCSCC

Molecular Weight¹

116.22

• 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	0.2280		Relay (... Calculated Property
ΔfG°	112.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-34.90	kJ/mol	Relay (... Calculated Property
ΔfusH°	15.63	kJ/mol	Joback Calculated Property
ΔvapH°	45.02	kJ/mol	Relay (... Calculated Property
IE	8.28	eV	Relay (... Calculated Property
log10WS	-2.36		Relay (... Calculated Property
logPoct/wat	2.316		Crippen Calculated Property
McVol	107.450	ml/mol	McGowan Calculated Property
Pc	3360.64	kPa	Joback Calculated Property
Inp	[942.00; 942.00]
Inp	942.00		NIST
Inp	942.00		NIST
Tboil	420.37	K	Relay (... Calculated Property
Tc	588.65	K	Relay (... Calculated Property
Tfus	175.41	K	Relay (... Calculated Property
Vc	0.375	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[191.21; 250.59]	J/mol×K	[409.62; 608.36]
Cp,gas	191.21	J/mol×K	409.62	Joback Calculated Property
Cp,gas	202.37	J/mol×K	442.74	Joback Calculated Property
Cp,gas	213.00	J/mol×K	475.87	Joback Calculated Property
Cp,gas	223.11	J/mol×K	508.99	Joback Calculated Property
Cp,gas	232.74	J/mol×K	542.11	Joback Calculated Property
Cp,gas	241.89	J/mol×K	575.24	Joback Calculated Property
Cp,gas	250.59	J/mol×K	608.36	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-(Ethylthiomethyl)propene.

Sources

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

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