Chemical Properties of Cyclopropanecarboxylic acid, 2,2-dichloro-1-methyl-, methyl ester (CAS 1447-13-8)

InChI

InChI=1S/C6H8Cl2O2/c1-5(4(9)10-2)3-6(5,7)8/h3H2,1-2H3

InChI Key

JGCAZFUFORGMFB-UHFFFAOYSA-N

Formula

C6H8Cl2O2

SMILES

COC(=O)C1(C)CC1(Cl)Cl

Molecular Weight¹

183.03

CAS

1447-13-8

Other Names

• Methyl 2,2-dichloro-1-methylcyclopropanecarboxylate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[235.61; 283.75]	J/mol×K	[490.38; 713.66]
Cp,gas	235.61	J/mol×K	490.38	Joback Calculated Property
Cp,gas	245.46	J/mol×K	527.59	Joback Calculated Property
Cp,gas	254.30	J/mol×K	564.81	Joback Calculated Property
Cp,gas	262.34	J/mol×K	602.02	Joback Calculated Property
Cp,gas	269.78	J/mol×K	639.23	Joback Calculated Property
Cp,gas	276.85	J/mol×K	676.45	Joback Calculated Property
Cp,gas	283.75	J/mol×K	713.66	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, 2,2-dichloro-1-methyl-, methyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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