- InChI
- InChI=1S/C15H24O3/c1-6-10(2)11-7-12(9-18-17)14(16)13(8-11)15(3,4)5/h7-8,10,16-17H,6,9H2,1-5H3
- InChI Key
- HVMLPRKOWGHNKO-UHFFFAOYSA-N
- Formula
- C15H24O3
- SMILES
-
CCC(C)c1cc(COO)c(O)c(C(C)(C)C)
c1 - Molecular Weight1
- 252.35
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : 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).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -329.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -680.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.08 | kJ/mol | Joback Calculated Property |
| log10WS | -4.22 | Crippen Calculated Property | |
| logPoct/wat | 4.193 | Crippen Calculated Property | |
| McVol | 216.060 | ml/mol | McGowan Calculated Property |
| Pc | 2151.31 | kPa | Joback Calculated Property |
| Inp | [1753.00; 1753.00] |
|
|
| Inp | 1753.00 | NIST | |
| Inp | 1753.00 | NIST | |
| Tboil | 801.70 | K | Joback Calculated Property |
| Tc | 1028.56 | K | Joback Calculated Property |
| Tfus | 570.01 | K | Joback Calculated Property |
| Vc | 0.741 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [637.15; 712.54] | J/mol×K | [801.70; 1028.56] |
|
| Cp,gas | 637.15 | J/mol×K | 801.70 | Joback Calculated Property |
| Cp,gas | 651.08 | J/mol×K | 839.51 | Joback Calculated Property |
| Cp,gas | 664.30 | J/mol×K | 877.32 | Joback Calculated Property |
| Cp,gas | 676.94 | J/mol×K | 915.13 | Joback Calculated Property |
| Cp,gas | 689.11 | J/mol×K | 952.94 | Joback Calculated Property |
| Cp,gas | 700.93 | J/mol×K | 990.75 | Joback Calculated Property |
| Cp,gas | 712.54 | J/mol×K | 1028.56 | Joback Calculated Property |
| η | [0.0000055; 0.0000770] | Pa×s | [570.01; 801.70] |
|
| η | 0.0000770 | Pa×s | 570.01 | Joback Calculated Property |
| η | 0.0000431 | Pa×s | 608.62 | Joback Calculated Property |
| η | 0.0000258 | Pa×s | 647.24 | Joback Calculated Property |
| η | 0.0000164 | Pa×s | 685.86 | Joback Calculated Property |
| η | 0.0000109 | Pa×s | 724.47 | Joback Calculated Property |
| η | 0.0000076 | Pa×s | 763.09 | Joback Calculated Property |
| η | 0.0000055 | Pa×s | 801.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-sec-Butyl-2-tert-butyl-6-hydroperoxymethyl-phenol.
Sources
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