- InChI
- InChI=1S/C26H38O12/c1-23(2,3)35-31-19(27)15-13-17(21(29)33-37-25(7,8)9)18(22(30)34-38-26(10,11)12)14-16(15)20(28)32-36-24(4,5)6/h13-14H,1-12H3
- InChI Key
- KOAKWBXPXOTXGD-UHFFFAOYSA-N
- Formula
- C26H38O12
- SMILES
-
CC(C)(C)OOC(=O)c1cc(C(=O)OOC(C
)(C)C)c(C(=O)OOC(C)(C)C)cc1C(= O)OOC(C)(C)C - Molecular Weight1
- 542.57
- CAS
- 63472-69-5
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°solid | -14126.60 ± 7.60 | kJ/mol | NIST |
| ΔfH°gas | -1615.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -1536.10 ± 7.60 | kJ/mol | NIST |
| ΔfusH° | 48.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.87 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.234 | Crippen Calculated Property | |
| McVol | 406.680 | ml/mol | McGowan Calculated Property |
| Tfus | 378.22 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 | [1355.88; 1382.17] | J/mol×K | [1145.74; 1406.46] | 
|
| Cp,gas | 1378.36 | J/mol×K | 1145.74 | Joback Calculated Property |
| Cp,gas | 1381.72 | J/mol×K | 1189.19 | Joback Calculated Property |
| Cp,gas | 1382.17 | J/mol×K | 1232.65 | Joback Calculated Property |
| Cp,gas | 1379.77 | J/mol×K | 1276.10 | Joback Calculated Property |
| Cp,gas | 1374.56 | J/mol×K | 1319.55 | Joback Calculated Property |
| Cp,gas | 1366.58 | J/mol×K | 1363.01 | Joback Calculated Property |
| Cp,gas | 1355.88 | J/mol×K | 1406.46 | Joback Calculated Property |
| η | [0.0000005; 0.0000095] | Pa×s | [714.68; 1145.74] |
|
| η | 0.0000095 | Pa×s | 714.68 | Joback Calculated Property |
| η | 0.0000046 | Pa×s | 786.52 | Joback Calculated Property |
| η | 0.0000025 | Pa×s | 858.37 | Joback Calculated Property |
| η | 0.0000015 | Pa×s | 930.21 | Joback Calculated Property |
| η | 0.0000010 | Pa×s | 1002.05 | Joback Calculated Property |
| η | 0.0000007 | Pa×s | 1073.90 | Joback Calculated Property |
| η | 0.0000005 | Pa×s | 1145.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tetra-t-butylperoxypyromellitate.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- 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.
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