Chemical Properties of 2-((Z)-2-butenyl)thiazolidine

InChI

InChI=1S/C7H13NS/c1-2-3-4-7-8-5-6-9-7/h2-3,7-8H,4-6H2,1H3/b3-2-

InChI Key

NVCZSVLOACZRHY-IHWYPQMZSA-N

Formula

C7H13NS

SMILES

CC=CCC1NCCS1

Molecular Weight¹

143.25

• 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	0.2984		Relay (1.0) Calculated Property
ΔfG°	252.40	kJ/mol	Joback Calculated Property
ΔfH°gas	24.97	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	21.27	kJ/mol	Joback Calculated Property
ΔvapH°	67.94	kJ/mol	Relay (1.0) Calculated Property
IE	8.75	eV	Relay (1.0) Calculated Property
log10WS	-0.99		Relay (1.0) Calculated Property
logPoct/wat	1.615		Crippen Calculated Property
McVol	120.660	ml/mol	McGowan Calculated Property
Pc	3722.56	kPa	Joback Calculated Property
Inp	[1176.00; 1176.00]
Inp	1176.00		NIST
Inp	1176.00		NIST
Tboil	484.76	K	Relay (1.0) Calculated Property
Tc	689.24	K	Relay (1.0) Calculated Property
Tfus	298.34	K	Relay (1.0) Calculated Property
Vc	0.400	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[246.70; 325.27]	J/mol×K	[475.38; 704.29]
Cp,gas	246.70	J/mol×K	475.38	Joback Calculated Property
Cp,gas	261.96	J/mol×K	513.53	Joback Calculated Property
Cp,gas	276.29	J/mol×K	551.68	Joback Calculated Property
Cp,gas	289.75	J/mol×K	589.83	Joback Calculated Property
Cp,gas	302.36	J/mol×K	627.99	Joback Calculated Property
Cp,gas	314.19	J/mol×K	666.14	Joback Calculated Property
Cp,gas	325.27	J/mol×K	704.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-((Z)-2-butenyl)thiazolidine.

Sources

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

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