Chemical Properties of 2-Chloro-6-fluorobenzyl alcohol, 2-methylpropyl ether

InChI

InChI=1S/C11H14ClFO/c1-8(2)6-14-7-9-10(12)4-3-5-11(9)13/h3-5,8H,6-7H2,1-2H3

InChI Key

USRZSMBUILAMOK-UHFFFAOYSA-N

Formula

C11H14ClFO

SMILES

CC(C)COCc1c(F)cccc1Cl

Molecular Weight¹

216.68

• 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°	-179.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-406.13	kJ/mol	Joback Calculated Property
ΔfusH°	22.45	kJ/mol	Joback Calculated Property
ΔvapH°	49.27	kJ/mol	Joback Calculated Property
log10WS	-3.89		Crippen Calculated Property
logPoct/wat	3.652		Crippen Calculated Property
McVol	161.970	ml/mol	McGowan Calculated Property
Pc	2347.36	kPa	Joback Calculated Property
Inp	[1358.00; 1358.00]
Inp	1358.00		NIST
Inp	1358.00		NIST
Tboil	546.40	K	Joback Calculated Property
Tc	748.23	K	Joback Calculated Property
Tfus	302.93	K	Joback Calculated Property
Vc	0.623	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[363.48; 436.70]	J/mol×K	[546.40; 748.23]
Cp,gas	363.48	J/mol×K	546.40	Joback Calculated Property
Cp,gas	377.37	J/mol×K	580.04	Joback Calculated Property
Cp,gas	390.57	J/mol×K	613.68	Joback Calculated Property
Cp,gas	403.09	J/mol×K	647.32	Joback Calculated Property
Cp,gas	414.94	J/mol×K	680.96	Joback Calculated Property
Cp,gas	426.14	J/mol×K	714.60	Joback Calculated Property
Cp,gas	436.70	J/mol×K	748.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Chloro-6-fluorobenzyl alcohol, 2-methylpropyl ether.

Sources

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

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