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

• ω : Acentric Factor.
• 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).
• 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).
• 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
ω	0.4291		Relay (... Calculated Property
ΔfG°	-648.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-801.79	kJ/mol	Relay (... Calculated Property
ΔfusH°	17.62	kJ/mol	Joback Calculated Property
ΔvapH°	48.57	kJ/mol	Relay (... Calculated Property
IE	9.66	eV	Relay (... Calculated Property
log10WS	-2.71		Relay (... 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	436.08	K	Relay (... Calculated Property
Tc	643.97	K	Relay (... Calculated Property
Tfus	236.61	K	Relay (... Calculated Property
Vc	0.455	m3/kmol	Relay (... 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

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.