Chemical Properties of 2-Octen-4-one, 5,5,6,6,7,7,8,8-octafluoro-2-mercapto- (CAS 88552-04-9)

InChI

InChI=1S/C8H6F8OS/c1-3(18)2-4(17)6(11,12)8(15,16)7(13,14)5(9)10/h2,5,18H,1H3/b3-2-

InChI Key

VHMCYEKUYBMISA-IHWYPQMZSA-N

Formula

C8H6F8OS

SMILES

CC(S)=CC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

302.19

CAS

88552-04-9

• 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).
• 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	[363.73; 420.01]	J/mol×K	[487.24; 658.56]
Cp,gas	363.73	J/mol×K	487.24	Joback Calculated Property
Cp,gas	375.16	J/mol×K	515.79	Joback Calculated Property
Cp,gas	385.70	J/mol×K	544.35	Joback Calculated Property
Cp,gas	395.40	J/mol×K	572.90	Joback Calculated Property
Cp,gas	404.32	J/mol×K	601.45	Joback Calculated Property
Cp,gas	412.50	J/mol×K	630.01	Joback Calculated Property
Cp,gas	420.01	J/mol×K	658.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Octen-4-one, 5,5,6,6,7,7,8,8-octafluoro-2-mercapto-.

Sources

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

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