- InChI
- InChI=1S/C15H24O/c1-11-9-12(7-8-13(11)16)15(5,6)10-14(2,3)4/h7-9,16H,10H2,1-6H3
- InChI Key
- DYKCNMUCTREDMF-UHFFFAOYSA-N
- Formula
- C15H24O
- SMILES
- Cc1cc(C(C)(C)CC(C)(C)C)ccc1O
- Molecular Weight1
- 220.35
- CAS
- 2219-84-3
- Other Names
-
- 4-tert-Octyl-o-Cresol
- o-Cresol, 4-(1,1,3,3-tetramethylbutyl)-
- 2-Methyl-4-tert-octylphenol
- 4-(1,1,3,3-Tetramethylbutyl)-o-cresol
- 2-Methyl-4-(1,1,3,3-tetramethylbutyl)phenol
- 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).
- 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° | 29.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -322.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.34 | kJ/mol | Joback Calculated Property |
| log10WS | -4.24 | Crippen Calculated Property | |
| logPoct/wat | 4.414 | Crippen Calculated Property | |
| McVol | 204.320 | ml/mol | McGowan Calculated Property |
| Pc | 2153.30 | kPa | Joback Calculated Property |
| Tboil | 648.42 | K | Joback Calculated Property |
| Tc | 874.26 | K | Joback Calculated Property |
| Tfus | 414.31 | K | Joback Calculated Property |
| Vc | 0.712 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [562.97; 655.71] | J/mol×K | [648.42; 874.26] | 
|
| Cp,gas | 562.97 | J/mol×K | 648.42 | Joback Calculated Property |
| Cp,gas | 581.07 | J/mol×K | 686.06 | Joback Calculated Property |
| Cp,gas | 597.93 | J/mol×K | 723.70 | Joback Calculated Property |
| Cp,gas | 613.68 | J/mol×K | 761.34 | Joback Calculated Property |
| Cp,gas | 628.46 | J/mol×K | 798.98 | Joback Calculated Property |
| Cp,gas | 642.42 | J/mol×K | 836.62 | Joback Calculated Property |
| Cp,gas | 655.71 | J/mol×K | 874.26 | Joback Calculated Property |
| η | [0.0000145; 0.0008688] | Pa×s | [414.31; 648.42] |
|
| η | 0.0008688 | Pa×s | 414.31 | Joback Calculated Property |
| η | 0.0003273 | Pa×s | 453.33 | Joback Calculated Property |
| η | 0.0001440 | Pa×s | 492.35 | Joback Calculated Property |
| η | 0.0000714 | Pa×s | 531.37 | Joback Calculated Property |
| η | 0.0000390 | Pa×s | 570.38 | Joback Calculated Property |
| η | 0.0000230 | Pa×s | 609.40 | Joback Calculated Property |
| η | 0.0000145 | Pa×s | 648.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 2-methyl-4-(1,1,3,3-tetramethylbutyl)-.
Sources
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