Chemical Properties of 4-Nonen-3-one, 1,1,2,2-tetrafluoro-5-mercapto- (CAS 64249-77-0)

InChI

InChI=1S/C9H12F4OS/c1-2-3-4-6(15)5-7(14)9(12,13)8(10)11/h5,8,15H,2-4H2,1H3/b6-5-

InChI Key

MNHDCVLGHNJPRI-WAYWQWQTSA-N

Formula

C9H12F4OS

SMILES

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

Molecular Weight¹

244.25

CAS

64249-77-0

• 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	[368.50; 432.55]	J/mol×K	[519.50; 702.74]
Cp,gas	368.50	J/mol×K	519.50	Joback Calculated Property
Cp,gas	380.94	J/mol×K	550.04	Joback Calculated Property
Cp,gas	392.62	J/mol×K	580.58	Joback Calculated Property
Cp,gas	403.58	J/mol×K	611.12	Joback Calculated Property
Cp,gas	413.87	J/mol×K	641.66	Joback Calculated Property
Cp,gas	423.51	J/mol×K	672.20	Joback Calculated Property
Cp,gas	432.55	J/mol×K	702.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Nonen-3-one, 1,1,2,2-tetrafluoro-5-mercapto-.

Sources

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

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