Chemical Properties of 2,3,4,5-Tetrafluorobenzyl alcohol, chlorodifluoroacetate

InChI

InChI=1S/C9H3ClF6O2/c10-9(15,16)8(17)18-2-3-1-4(11)6(13)7(14)5(3)12/h1H,2H2

InChI Key

ZMVNXEPMQCKYLS-UHFFFAOYSA-N

Formula

C9H3ClF6O2

SMILES

O=C(OCc1cc(F)c(F)c(F)c1F)C(F)(F)Cl

Molecular Weight¹

292.56

• 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°	-1313.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-1484.39	kJ/mol	Joback Calculated Property
ΔfusH°	29.60	kJ/mol	Joback Calculated Property
ΔvapH°	47.89	kJ/mol	Joback Calculated Property
log10WS	-4.34		Crippen Calculated Property
logPoct/wat	3.118		Crippen Calculated Property
McVol	144.210	ml/mol	McGowan Calculated Property
Pc	2372.59	kPa	Joback Calculated Property
Inp	[1125.00; 1125.00]
Inp	1125.00		NIST
Inp	1125.00		NIST
Tboil	558.03	K	Joback Calculated Property
Tc	737.52	K	Joback Calculated Property
Tfus	375.73	K	Joback Calculated Property
Vc	0.602	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[332.06; 375.31]	J/mol×K	[558.03; 737.52]
Cp,gas	332.06	J/mol×K	558.03	Joback Calculated Property
Cp,gas	340.40	J/mol×K	587.94	Joback Calculated Property
Cp,gas	348.27	J/mol×K	617.86	Joback Calculated Property
Cp,gas	355.69	J/mol×K	647.77	Joback Calculated Property
Cp,gas	362.66	J/mol×K	677.69	Joback Calculated Property
Cp,gas	369.19	J/mol×K	707.60	Joback Calculated Property
Cp,gas	375.31	J/mol×K	737.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,3,4,5-Tetrafluorobenzyl alcohol, chlorodifluoroacetate.

Sources

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

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