Chemical Properties of Didodecyl hexanedioate (CAS 3072-02-4)

InChI

InChI=1S/C30H58O4/c1-3-5-7-9-11-13-15-17-19-23-27-33-29(31)25-21-22-26-30(32)34-28-24-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3

InChI Key

GHKVUVOPHDYRJC-UHFFFAOYSA-N

Formula

C30H58O4

SMILES

CCCCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCC

Molecular Weight¹

482.78

CAS

3072-02-4

Other Names

• dilauryl adipate

• 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).
• 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).
• 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 Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[674.57; 1583.28]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			2.64360e+01
Coefficient B			2.74424e+00
Coefficient C			-1.41900e-03
Coefficient D			2.31600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	674.57	J/mol×K	273.00	Calculated Property
Cp,gas	829.94	J/mol×K	353.78	Calculated Property
Cp,gas	970.00	J/mol×K	434.56	Calculated Property
Cp,gas	1095.49	J/mol×K	515.33	Calculated Property
Cp,gas	1207.13	J/mol×K	596.11	Calculated Property
Cp,gas	1305.65	J/mol×K	676.89	Calculated Property
Cp,gas	1391.80	J/mol×K	757.67	Calculated Property
Cp,gas	1466.30	J/mol×K	838.44	Calculated Property
Cp,gas	1529.88	J/mol×K	919.22	Calculated Property
Cp,gas	1583.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0460785; 0.0000150]	Pa×s	[313.45; 878.19]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.55664e+01
Coefficient B			3.91468e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			313.45
Temperature range, max.			878.19
η	0.0460785	Pa×s	313.45	Calculated Property
η	0.0057386	Pa×s	376.20	Calculated Property
η	0.0012965	Pa×s	438.95	Calculated Property
η	0.0004249	Pa×s	501.70	Calculated Property
η	0.0001785	Pa×s	564.45	Calculated Property
η	0.0000892	Pa×s	627.20	Calculated Property
η	0.0000506	Pa×s	689.94	Calculated Property
η	0.0000315	Pa×s	752.69	Calculated Property
η	0.0000211	Pa×s	815.44	Calculated Property
η	0.0000150	Pa×s	878.19	Calculated Property

Similar Compounds

Find more compounds similar to Didodecyl hexanedioate.

Sources

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

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