Chemical Properties of 1,5,7,11-Tetrathiaspiro[5.5]undecane (CAS 180-97-2)

InChI

InChI=1S/C7H12S4/c1-3-8-7(9-4-1)10-5-2-6-11-7/h1-6H2

InChI Key

LZGXFMIPVMFXAQ-UHFFFAOYSA-N

Formula

C7H12S4

SMILES

C1CSC2(SC1)SCCCS2

Molecular Weight¹

224.43

CAS

180-97-2

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[339.79; 430.49]	J/mol×K	[590.62; 911.27]
Cp,gas	339.79	J/mol×K	590.62	Joback Calculated Property
Cp,gas	357.65	J/mol×K	644.06	Joback Calculated Property
Cp,gas	373.83	J/mol×K	697.50	Joback Calculated Property
Cp,gas	388.76	J/mol×K	750.94	Joback Calculated Property
Cp,gas	402.88	J/mol×K	804.38	Joback Calculated Property
Cp,gas	416.65	J/mol×K	857.82	Joback Calculated Property
Cp,gas	430.49	J/mol×K	911.27	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,5,7,11-Tetrathiaspiro[5.5]undecane.

Sources

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

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