Chemical Properties of Nonanedioic acid, bis(2-ethylhexyl) ester (CAS 103-24-2)

InChI

InChI=1S/C25H48O4/c1-5-9-16-22(7-3)20-28-24(26)18-14-12-11-13-15-19-25(27)29-21-23(8-4)17-10-6-2/h22-23H,5-21H2,1-4H3

InChI Key

ZDWGXBPVPXVXMQ-UHFFFAOYSA-N

Formula

C25H48O4

SMILES

CCCCC(CC)COC(=O)CCCCCCCC(=O)OCC(CC)CCCC

Molecular Weight¹

412.65

CAS

103-24-2

Other Names

• Azelaic acid, bis(2-ethylhexyl) ester
• Azelaic acid, di(2-ethylhexyl) ester
• Bis(2-ethylhexyl) azelate
• Di(2-ethylhexyl) azelate
• DOZ
• Plastolein 9058
• Plastolein 9058DOZ
• Staflex DOX
• Truflex DOX
• Bis-(2-ethylhexyl)ester kyseliny azelaove
• Dioctyl azelate
• Nonanedioic acid, di-2-ethylhexyl ester
• Emery 2958
• Emolien 2986
• Nonanedioic acid, 1,9-bis(2-ethylhexyl) ester
• Sansocizer DOZ

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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	1.1200		Relay (1.0) Calculated Property
ΔfH°gas	-1200.61	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	62.20	kJ/mol	Joback Calculated Property
ΔvapH°	111.00	kJ/mol	Relay (1.0) Calculated Property
log10WS	-6.55		Relay (1.0) Calculated Property
logPoct/wat	7.236		Crippen Calculated Property
McVol	377.990	ml/mol	McGowan Calculated Property
Pc	775.05	kPa	Joback Calculated Property
Inp	[2669.00; 2669.00]
Inp	2669.00		NIST
Inp	2669.00		NIST
Tboil	647.14	K	Relay (1.0) Calculated Property
Tc	817.94	K	Relay (1.0) Calculated Property
Tfus	222.85	K	Relay (1.0) Calculated Property
Vc	1.422	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[1262.98; 1364.05]	J/mol×K	[887.16; 1086.91]
Cp,gas	1262.98	J/mol×K	887.16	Joback Calculated Property
Cp,gas	1283.47	J/mol×K	920.45	Joback Calculated Property
Cp,gas	1302.46	J/mol×K	953.74	Joback Calculated Property
Cp,gas	1319.97	J/mol×K	987.04	Joback Calculated Property
Cp,gas	1336.05	J/mol×K	1020.33	Joback Calculated Property
Cp,gas	1350.73	J/mol×K	1053.62	Joback Calculated Property
Cp,gas	1364.05	J/mol×K	1086.91	Joback Calculated Property
η	[0.0000162; 0.0011851]	Pa×s	[426.17; 887.16]
η	0.0011851	Pa×s	426.17	Joback Calculated Property
η	0.0003357	Pa×s	503.00	Joback Calculated Property
η	0.0001328	Pa×s	579.83	Joback Calculated Property
η	0.0000653	Pa×s	656.66	Joback Calculated Property
η	0.0000372	Pa×s	733.50	Joback Calculated Property
η	0.0000236	Pa×s	810.33	Joback Calculated Property
η	0.0000162	Pa×s	887.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Nonanedioic acid, bis(2-ethylhexyl) 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.
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