Chemical Properties of 1,3,5-Cyclohexanetriol, 2,2,4,4,6,6-hexamethyl-, triisobutyrate (CAS 101611-75-0)

1,3,5-Cyclohexanetriol, 2,2,4,4,6,6-hexamethyl-, triisobutyrate

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InChI
InChI=1S/C24H42O6/c1-13(2)16(25)28-19-22(7,8)20(29-17(26)14(3)4)24(11,12)21(23(19,9)10)30-18(27)15(5)6/h13-15,19-21H,1-12H3
InChI Key
UQSQGZQFVQERPO-UHFFFAOYSA-N
Formula
C24H42O6
SMILES
CC(C)C(=O)OC1C(C)(C)C(OC(=O)C(C)C)C(C)(C)C(OC(=O)C(C)C)C1(C)C
Molecular Weight1
426.59
CAS
101611-75-0
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Physical Properties

Property Value Unit Source
ΔfG° -588.45 kJ/mol Joback Calculated Property
ΔfH°gas -1290.59 kJ/mol Joback Calculated Property
ΔfusH° 34.00 kJ/mol Joback Calculated Property
ΔvapH° 90.75 kJ/mol Joback Calculated Property
log10WS -5.24 Crippen Calculated Property
logPoct/wat 4.782 Crippen Calculated Property
McVol 360.480 ml/mol McGowan Calculated Property
Pc 985.78 kPa Joback Calculated Property
Tboil 972.99 K Joback Calculated Property
Tc 1194.94 K Joback Calculated Property
Tfus 589.60 K Joback Calculated Property
Vc 1.355 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1300.12; 1496.26] J/mol×K [972.99; 1194.94] Show Hide
Cp,gas 1300.12 J/mol×K 972.99 Joback Calculated Property
Cp,gas 1330.22 J/mol×K 1009.98 Joback Calculated Property
Cp,gas 1361.02 J/mol×K 1046.97 Joback Calculated Property
Cp,gas 1392.76 J/mol×K 1083.97 Joback Calculated Property
Cp,gas 1425.71 J/mol×K 1120.96 Joback Calculated Property
Cp,gas 1460.12 J/mol×K 1157.95 Joback Calculated Property
Cp,gas 1496.26 J/mol×K 1194.94 Joback Calculated Property

Similar Compounds

1,3,5-Cyclohexanetriol, 2,2,4,4,6,6-hexamethyl-, tripelargonate. 1,3-Cyclobutanediol, 2,4-diethyl-2,4-dimethyl-, dipelargonate. 2,2,4-Trimethyl-1,3-pentanediol diisobutyrate. 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-, nonanoate, 2-ethylhexanoate. 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-, mono(2-ethylhexanoate). 2,4,4-Trimethylpentane-1,3-diol diisobutyrate. 2,2,4-Trimethyl-1,3-pentanediol diacetate. 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-, monohexanoate. 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-, monopelargonate. 6-hydroxy-Isobornyl Isobutyrate. 2-Methylpropanoic acid, 2,2-dimethyl-1-(2-hydroxy-1-methylethyl)propyl ester. 3-hydroxy-2,2,4-trimethylpentyl isobutyrate. exo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl isobutyrate. Bornyl isobutyrate. Trans-1,3-cyclobutanediol, 2,2,4,4-tetramethyl-, diacetate.

Find more compounds similar to 1,3,5-Cyclohexanetriol, 2,2,4,4,6,6-hexamethyl-, triisobutyrate.

Sources

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