Chemical Properties of Dimethylmalonic acid, 2-methylpent-3-yl tetradecyl ester

InChI

InChI=1S/C25H48O4/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-28-23(26)25(5,6)24(27)29-22(8-2)21(3)4/h21-22H,7-20H2,1-6H3

InChI Key

JUFIXXXJDJNBPA-UHFFFAOYSA-N

Formula

C25H48O4

SMILES

CCCCCCCCCCCCCCOC(=O)C(C)(C)C(=O)OC(CC)C(C)C

Molecular Weight¹

412.65

• 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	1.0554		Relay (1.0) Calculated Property
ΔfG°	-310.26	kJ/mol	Joback Calculated Property
ΔfH°gas	-1191.70	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	51.62	kJ/mol	Joback Calculated Property
ΔvapH°	104.72	kJ/mol	Relay (1.0) Calculated Property
IE	9.73	eV	Relay (1.0) Calculated Property
log10WS	-6.66		Relay (1.0) Calculated Property
logPoct/wat	7.235		Crippen Calculated Property
McVol	377.990	ml/mol	McGowan Calculated Property
Pc	820.54	kPa	Joback Calculated Property
Inp	[2567.00; 2567.00]
Inp	2567.00		NIST
Inp	2567.00		NIST
Tboil	619.26	K	Relay (1.0) Calculated Property
Tc	812.28	K	Relay (1.0) Calculated Property
Tfus	276.02	K	Relay (1.0) Calculated Property
Vc	1.436	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1281.85; 1382.95]	J/mol×K	[919.87; 1126.52]
Cp,gas	1281.85	J/mol×K	919.87	Joback Calculated Property
Cp,gas	1302.06	J/mol×K	954.31	Joback Calculated Property
Cp,gas	1320.85	J/mol×K	988.75	Joback Calculated Property
Cp,gas	1338.27	J/mol×K	1023.20	Joback Calculated Property
Cp,gas	1354.40	J/mol×K	1057.64	Joback Calculated Property
Cp,gas	1369.27	J/mol×K	1092.08	Joback Calculated Property
Cp,gas	1382.95	J/mol×K	1126.52	Joback Calculated Property
η	[0.0000162; 0.0005773]	Pa×s	[488.25; 919.87]
η	0.0005773	Pa×s	488.25	Joback Calculated Property
η	0.0002172	Pa×s	560.19	Joback Calculated Property
η	0.0001021	Pa×s	632.12	Joback Calculated Property
η	0.0000560	Pa×s	704.06	Joback Calculated Property
η	0.0000343	Pa×s	776.00	Joback Calculated Property
η	0.0000228	Pa×s	847.93	Joback Calculated Property
η	0.0000162	Pa×s	919.87	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dimethylmalonic acid, 2-methylpent-3-yl tetradecyl ester.

Sources

• Cheméo Relay (1.0)
• 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.