Chemical Properties of Benzene, 1-(2-fluoroethyl)-3-trifluoromethyl

InChI

InChI=1S/C9H8F4/c10-5-4-7-2-1-3-8(6-7)9(11,12)13/h1-3,6H,4-5H2

InChI Key

QMWQYBIKMAPQRB-UHFFFAOYSA-N

Formula

C9H8F4

SMILES

FCCc1cccc(C(F)(F)F)c1

Molecular Weight¹

192.15

• 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

Property	Value	Unit	Source
ΔfG°	-648.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-797.22	kJ/mol	Joback Calculated Property
ΔfusH°	17.62	kJ/mol	Joback Calculated Property
ΔvapH°	34.00	kJ/mol	Joback Calculated Property
log10WS	-3.23		Crippen Calculated Property
logPoct/wat	3.217		Crippen Calculated Property
McVol	120.990	ml/mol	McGowan Calculated Property
Pc	2693.00	kPa	Joback Calculated Property
Inp	[961.00; 961.00]
Inp	961.00		NIST
Inp	961.00		NIST
Inp	961.00		NIST
Tboil	430.83	K	Joback Calculated Property
Tc	609.85	K	Joback Calculated Property
Tfus	234.91	K	Joback Calculated Property
Vc	0.492	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[251.28; 314.91]	J/mol×K	[430.83; 609.85]
Cp,gas	251.28	J/mol×K	430.83	Joback Calculated Property
Cp,gas	263.58	J/mol×K	460.67	Joback Calculated Property
Cp,gas	275.16	J/mol×K	490.50	Joback Calculated Property
Cp,gas	286.05	J/mol×K	520.34	Joback Calculated Property
Cp,gas	296.29	J/mol×K	550.18	Joback Calculated Property
Cp,gas	305.90	J/mol×K	580.02	Joback Calculated Property
Cp,gas	314.91	J/mol×K	609.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-(2-fluoroethyl)-3-trifluoromethyl.

Sources

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

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