Chemical Properties of 2-Heptanone, 6-methyl-5,6-bis-(methylthio)

InChI

InChI=1S/C10H20OS2/c1-8(11)6-7-9(12-4)10(2,3)13-5/h9H,6-7H2,1-5H3

InChI Key

UMXGLMGMLUBWGC-UHFFFAOYSA-N

Formula

C10H20OS2

SMILES

CSC(CCC(C)=O)C(C)(C)SC

Molecular Weight¹

220.40

• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[459.43; 540.75]	J/mol×K	[615.96; 840.20]
Cp,gas	459.43	J/mol×K	615.96	Joback Calculated Property
Cp,gas	475.45	J/mol×K	653.33	Joback Calculated Property
Cp,gas	490.44	J/mol×K	690.71	Joback Calculated Property
Cp,gas	504.43	J/mol×K	728.08	Joback Calculated Property
Cp,gas	517.45	J/mol×K	765.45	Joback Calculated Property
Cp,gas	529.54	J/mol×K	802.83	Joback Calculated Property
Cp,gas	540.75	J/mol×K	840.20	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Heptanone, 6-methyl-5,6-bis-(methylthio).

Sources

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

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