Chemical Properties of Hexanedioic acid, 2-methyl-5-methylene-, dimethyl ester (CAS 4513-62-6)

InChI

InChI=1S/C10H16O4/c1-7(9(11)13-3)5-6-8(2)10(12)14-4/h8H,1,5-6H2,2-4H3

InChI Key

SUISJNPVANLQPB-UHFFFAOYSA-N

Formula

C10H16O4

SMILES

C=C(CCC(C)C(=O)OC)C(=O)OC

Molecular Weight¹

200.23

CAS

4513-62-6

Other Names

• Dimethyl ester of 2-methyl-5-methylene-1,6-hexanedioic acid
• dimethyl 2-methyl-5-methyleneadipate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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	[386.05; 457.99]	J/mol×K	[540.96; 725.51]
Cp,gas	386.05	J/mol×K	540.96	Joback Calculated Property
Cp,gas	399.64	J/mol×K	571.72	Joback Calculated Property
Cp,gas	412.58	J/mol×K	602.48	Joback Calculated Property
Cp,gas	424.88	J/mol×K	633.24	Joback Calculated Property
Cp,gas	436.55	J/mol×K	664.00	Joback Calculated Property
Cp,gas	447.59	J/mol×K	694.75	Joback Calculated Property
Cp,gas	457.99	J/mol×K	725.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexanedioic acid, 2-methyl-5-methylene-, dimethyl 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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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