- InChI
- InChI=1S/C17H26O2/c1-8-14(18)11-9-12(16(2,3)4)15(19)13(10-11)17(5,6)7/h9-10,19H,8H2,1-7H3
- InChI Key
- JGJQYHBWTHQSPR-UHFFFAOYSA-N
- Formula
- C17H26O2
- SMILES
-
CCC(=O)c1cc(C(C)(C)C)c(O)c(C(C
)(C)C)c1 - Molecular Weight1
- 262.39
- CAS
- 14035-34-8
- Other Names
-
- 3,5-Bis(tert.-butyl)-4-hydroxy-propiophenon
- 3,5-Bis(tert.-butyl)-4-hydroxy-propiophenone
- 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.
- I : 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° | -92.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -488.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.20 | kJ/mol | Joback Calculated Property |
| log10WS | -4.73 | Crippen Calculated Property | |
| logPoct/wat | 4.580 | Crippen Calculated Property | |
| McVol | 234.070 | ml/mol | McGowan Calculated Property |
| Pc | 1892.00 | kPa | Joback Calculated Property |
| Inp | [1635.00; 1644.00] |
|
|
| Inp | 1644.00 | NIST | |
| Inp | 1635.00 | NIST | |
| Inp | 1635.00 | NIST | |
| I | 2370.00 | NIST | |
| Tboil | 753.03 | K | Joback Calculated Property |
| Tc | 977.72 | K | Joback Calculated Property |
| Tfus | 499.30 | K | Joback Calculated Property |
| Vc | 0.830 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [689.92; 778.42] | J/mol×K | [753.03; 977.72] |
|
| Cp,gas | 689.92 | J/mol×K | 753.03 | Joback Calculated Property |
| Cp,gas | 706.66 | J/mol×K | 790.48 | Joback Calculated Property |
| Cp,gas | 722.42 | J/mol×K | 827.93 | Joback Calculated Property |
| Cp,gas | 737.34 | J/mol×K | 865.37 | Joback Calculated Property |
| Cp,gas | 751.56 | J/mol×K | 902.82 | Joback Calculated Property |
| Cp,gas | 765.20 | J/mol×K | 940.27 | Joback Calculated Property |
| Cp,gas | 778.42 | J/mol×K | 977.72 | Joback Calculated Property |
| η | [0.0000066; 0.0002052] | Pa×s | [499.30; 753.03] |
|
| η | 0.0002052 | Pa×s | 499.30 | Joback Calculated Property |
| η | 0.0000927 | Pa×s | 541.59 | Joback Calculated Property |
| η | 0.0000470 | Pa×s | 583.88 | Joback Calculated Property |
| η | 0.0000261 | Pa×s | 626.16 | Joback Calculated Property |
| η | 0.0000156 | Pa×s | 668.45 | Joback Calculated Property |
| η | 0.0000099 | Pa×s | 710.74 | Joback Calculated Property |
| η | 0.0000066 | Pa×s | 753.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Bis(1,1-dimethylethyl)-4-(1-oxopropyl)phenol.
Sources
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