Chemical Properties of Benzenemethanol, «alpha»-methyl-2-(trifluoromethyl)- (CAS 79756-81-3)

InChI

InChI=1S/C9H9F3O/c1-6(13)7-4-2-3-5-8(7)9(10,11)12/h2-6,13H,1H3

InChI Key

VGHBIJJTMFYTPY-UHFFFAOYSA-N

Formula

C9H9F3O

SMILES

CC(O)c1ccccc1C(F)(F)F

Molecular Weight¹

190.16

CAS

79756-81-3

Other Names

• Benzyl alcohol, «alpha»-methyl-o-(trifluoromethyl)-
• «alpha»-Methyl-2-(trifluoromethyl)benzyl alcohol
• «alpha»-Methyl-o-trifluoromethylbenzyl alcohol
• 1-[2-(Trifluoromethyl)phenyl]ethanol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[295.15; 350.54]	J/mol×K	[523.30; 706.82]
Cp,gas	295.15	J/mol×K	523.30	Joback Calculated Property
Cp,gas	305.96	J/mol×K	553.89	Joback Calculated Property
Cp,gas	316.10	J/mol×K	584.47	Joback Calculated Property
Cp,gas	325.59	J/mol×K	615.06	Joback Calculated Property
Cp,gas	334.47	J/mol×K	645.65	Joback Calculated Property
Cp,gas	342.78	J/mol×K	676.24	Joback Calculated Property
Cp,gas	350.54	J/mol×K	706.82	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Benzenemethanol, «alpha»-methyl-2-(trifluoromethyl)-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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