Chemical Properties of Acetic acid, 4-benzoyl-3-hydroxyphenoxy-, dodecyl ester

InChI

InChI=1S/C27H36O5/c1-2-3-4-5-6-7-8-9-10-14-19-31-26(29)21-32-23-17-18-24(25(28)20-23)27(30)22-15-12-11-13-16-22/h11-13,15-18,20,28H,2-10,14,19,21H2,1H3

InChI Key

UHPRCGHAUHEORR-UHFFFAOYSA-N

Formula

C27H36O5

SMILES

CCCCCCCCCCCCOC(=O)COc1ccc(C(=O)c2ccccc2)c(O)c1

Molecular Weight¹

440.58

• 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).
• 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, 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	[1248.79; 1329.77]	J/mol×K	[1090.83; 1335.59]
Cp,gas	1248.79	J/mol×K	1090.83	Joback Calculated Property
Cp,gas	1264.23	J/mol×K	1131.62	Joback Calculated Property
Cp,gas	1278.70	J/mol×K	1172.42	Joback Calculated Property
Cp,gas	1292.35	J/mol×K	1213.21	Joback Calculated Property
Cp,gas	1305.31	J/mol×K	1254.00	Joback Calculated Property
Cp,gas	1317.74	J/mol×K	1294.80	Joback Calculated Property
Cp,gas	1329.77	J/mol×K	1335.59	Joback Calculated Property
η	[0.0000005; 0.0000130]	Pa×s	[685.62; 1090.83]
η	0.0000130	Pa×s	685.62	Joback Calculated Property
η	0.0000058	Pa×s	753.15	Joback Calculated Property
η	0.0000030	Pa×s	820.69	Joback Calculated Property
η	0.0000017	Pa×s	888.22	Joback Calculated Property
η	0.0000010	Pa×s	955.76	Joback Calculated Property
η	0.0000007	Pa×s	1023.29	Joback Calculated Property
η	0.0000005	Pa×s	1090.83	Joback Calculated Property

Similar Compounds

Find more compounds similar to Acetic acid, 4-benzoyl-3-hydroxyphenoxy-, dodecyl ester.

Sources

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

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