Chemical Properties of Methyl 3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]propanoate

Methyl 3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]propanoate

InChI
InChI=1S/C18H28O3/c1-17(2,3)13-10-12(8-9-15(19)21-7)11-14(16(13)20)18(4,5)6/h10-11,20H,8-9H2,1-7H3
InChI Key
PXMJCECEFTYEKE-UHFFFAOYSA-N
Formula
C18H28O3
SMILES
COC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
Molecular Weight1
292.42
Other Names
  • Methyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate
  • Methylox
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Physical Properties

Property Value Unit Source
ΔfH°gas -661.51 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 30.96 kJ/mol Joback Calculated Property
ΔvapH° 101.52 kJ/mol Relay (1.0) Calculated Property
IE 7.78 eV Relay (1.0) Calculated Property
logPoct/wat 4.093 Crippen Calculated Property
McVol 254.030 ml/mol McGowan Calculated Property
Pc 1661.90 kPa Joback Calculated Property
Inp [1943.30; 1943.30]   Show Hide
Inp 1943.30 NIST
Inp 1943.30 NIST
Tboil 575.95 K Relay (1.0) Calculated Property
Tfus 351.35 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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 [768.56; 856.19] J/mol×K [780.46; 998.19] Show Hide
Cp,gas 768.56 J/mol×K 780.46 Joback Calculated Property
Cp,gas 785.30 J/mol×K 816.75 Joback Calculated Property
Cp,gas 801.03 J/mol×K 853.04 Joback Calculated Property
Cp,gas 815.87 J/mol×K 889.33 Joback Calculated Property
Cp,gas 829.93 J/mol×K 925.61 Joback Calculated Property
Cp,gas 843.34 J/mol×K 961.90 Joback Calculated Property
Cp,gas 856.19 J/mol×K 998.19 Joback Calculated Property
η [0.0000035; 0.0001507] Pa×s [502.97; 780.46] Show Hide
η 0.0001507 Pa×s 502.97 Joback Calculated Property
η 0.0000619 Pa×s 549.22 Joback Calculated Property
η 0.0000292 Pa×s 595.47 Joback Calculated Property
η 0.0000153 Pa×s 641.72 Joback Calculated Property
η 0.0000088 Pa×s 687.96 Joback Calculated Property
η 0.0000054 Pa×s 734.21 Joback Calculated Property
η 0.0000035 Pa×s 780.46 Joback Calculated Property

Similar Compounds

Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate]. thiobis(ethane-2,1-diyl) bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate). Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 2-[3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-1-oxopropyl]hydrazide. 2,2'-Ethylenebis(4-methyl-6-t-butylphenol). Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-. 4-sec-Butyl-2-tert-butyl-6-hydroperoxymethyl-phenol. Phenol, 2,2'-methylenebis[6-(1,1-dimethylethyl)-4-ethyl-. Propyl 3-(2-hydroxyphenyl)propanoate. 4-sec-Butyl-2-tert-butyl-6-hydroxym ethyl-phenol. P-cresol, 2,2'-ethylidene bis(6-(1-methylcyclohexyl))-. Ethyl 3-(2-hydroxyphenyl)propanoate. Phenol, 4,4'-butylidene bis(2,6-di-tert-butyl)-. Methyl 8,11,13-Abietadien-18-oate. Methyl dehydroabietate. 2,6-BIS-(1,1-DIMETHYL-PROPYL)-4-METHYL-PHENOL.

Find more compounds similar to Methyl 3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]propanoate.

Sources

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