Chemical Properties of Dimethylmalonic acid, 2-naphthylmethyl pentyl ester

InChI

InChI=1S/C21H26O4/c1-4-5-8-13-24-19(22)21(2,3)20(23)25-15-16-11-12-17-9-6-7-10-18(17)14-16/h6-7,9-12,14H,4-5,8,13,15H2,1-3H3

InChI Key

CCAJMQZZWYCLHR-UHFFFAOYSA-N

Formula

C21H26O4

SMILES

CCCCCOC(=O)C(C)(C)C(=O)OCc1ccc2ccccc2c1

Molecular Weight¹

342.43

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion 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

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Ionization energy 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	[850.75; 924.88]	J/mol×K	[843.93; 1059.55]
Cp,gas	850.75	J/mol×K	843.93	Joback Calculated Property
Cp,gas	865.87	J/mol×K	879.87	Joback Calculated Property
Cp,gas	879.78	J/mol×K	915.80	Joback Calculated Property
Cp,gas	892.56	J/mol×K	951.74	Joback Calculated Property
Cp,gas	904.28	J/mol×K	987.68	Joback Calculated Property
Cp,gas	915.03	J/mol×K	1023.61	Joback Calculated Property
Cp,gas	924.88	J/mol×K	1059.55	Joback Calculated Property
η	[0.0000568; 0.0007825]	Pa×s	[485.15; 843.93]
η	0.0007825	Pa×s	485.15	Joback Calculated Property
η	0.0003977	Pa×s	544.95	Joback Calculated Property
η	0.0002311	Pa×s	604.74	Joback Calculated Property
η	0.0001480	Pa×s	664.54	Joback Calculated Property
η	0.0001021	Pa×s	724.34	Joback Calculated Property
η	0.0000745	Pa×s	784.13	Joback Calculated Property
η	0.0000568	Pa×s	843.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dimethylmalonic acid, 2-naphthylmethyl pentyl ester.

Sources

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

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