Chemical Properties of Carbonic acid, 2,2,2-trichloroethyl 4-methoxyphenyl ester

InChI

InChI=1S/C10H9Cl3O4/c1-15-7-2-4-8(5-3-7)17-9(14)16-6-10(11,12)13/h2-5H,6H2,1H3

InChI Key

QYIOUVUYTVIJTD-UHFFFAOYSA-N

Formula

C10H9Cl3O4

SMILES

COc1ccc(OC(=O)OCC(Cl)(Cl)Cl)cc1

Molecular Weight¹

299.54

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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	0.6633		Relay (1.0) Calculated Property
ΔfG°	-340.77	kJ/mol	Joback Calculated Property
ΔfH°gas	-637.47	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	25.65	kJ/mol	Joback Calculated Property
ΔvapH°	87.91	kJ/mol	Relay (1.0) Calculated Property
IE	8.71	eV	Relay (1.0) Calculated Property
log10WS	-4.90		Relay (1.0) Calculated Property
logPoct/wat	3.581		Crippen Calculated Property
McVol	183.900	ml/mol	McGowan Calculated Property
Pc	2651.56	kPa	Joback Calculated Property
Inp	[1903.00; 1903.00]
Inp	1903.00		NIST
Inp	1903.00		NIST
Tboil	597.21	K	Relay (1.0) Calculated Property
Tc	796.32	K	Relay (1.0) Calculated Property
Tfus	364.46	K	Relay (1.0) Calculated Property
Vc	0.653	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[422.67; 473.94]	J/mol×K	[690.05; 922.00]
Cp,gas	422.67	J/mol×K	690.05	Joback Calculated Property
Cp,gas	433.36	J/mol×K	728.71	Joback Calculated Property
Cp,gas	443.17	J/mol×K	767.37	Joback Calculated Property
Cp,gas	452.12	J/mol×K	806.03	Joback Calculated Property
Cp,gas	460.22	J/mol×K	844.69	Joback Calculated Property
Cp,gas	467.49	J/mol×K	883.35	Joback Calculated Property
Cp,gas	473.94	J/mol×K	922.00	Joback Calculated Property
η	[0.0000937; 0.0006982]	Pa×s	[450.20; 690.05]
η	0.0006982	Pa×s	450.20	Joback Calculated Property
η	0.0004359	Pa×s	490.18	Joback Calculated Property
η	0.0002921	Pa×s	530.15	Joback Calculated Property
η	0.0002071	Pa×s	570.12	Joback Calculated Property
η	0.0001536	Pa×s	610.10	Joback Calculated Property
η	0.0001182	Pa×s	650.08	Joback Calculated Property
η	0.0000937	Pa×s	690.05	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, 2,2,2-trichloroethyl 4-methoxyphenyl ester.

Sources

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

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