Chemical Properties of Propionic acid, 2,3-dichloro-2-chloromethyl-, methyl ester (CAS 116594-64-0)

InChI

InChI=1S/C5H7Cl3O2/c1-10-4(9)5(8,2-6)3-7/h2-3H2,1H3

InChI Key

KLXRARKCCAQPMU-UHFFFAOYSA-N

Formula

C5H7Cl3O2

SMILES

COC(=O)C(Cl)(CCl)CCl

Molecular Weight¹

205.47

CAS

116594-64-0

• 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).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[234.65; 277.09]	J/mol×K	[499.15; 710.20]
Cp,gas	234.65	J/mol×K	499.15	Joback Calculated Property
Cp,gas	243.00	J/mol×K	534.32	Joback Calculated Property
Cp,gas	250.81	J/mol×K	569.50	Joback Calculated Property
Cp,gas	258.10	J/mol×K	604.67	Joback Calculated Property
Cp,gas	264.90	J/mol×K	639.85	Joback Calculated Property
Cp,gas	271.22	J/mol×K	675.02	Joback Calculated Property
Cp,gas	277.09	J/mol×K	710.20	Joback Calculated Property
η	[0.0003190; 0.0032418]	Pa×s	[310.45; 499.15]
η	0.0032418	Pa×s	310.45	Joback Calculated Property
η	0.0018441	Pa×s	341.90	Joback Calculated Property
η	0.0011536	Pa×s	373.35	Joback Calculated Property
η	0.0007762	Pa×s	404.80	Joback Calculated Property
η	0.0005530	Pa×s	436.25	Joback Calculated Property
η	0.0004123	Pa×s	467.70	Joback Calculated Property
η	0.0003190	Pa×s	499.15	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propionic acid, 2,3-dichloro-2-chloromethyl-, methyl ester.

Sources

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

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