- InChI
- InChI=1S/C15H24O/c1-5-10-15(3,4)11-12(2)13-6-8-14(16)9-7-13/h6-9,12,16H,5,10-11H2,1-4H3
- InChI Key
- MKNWAGIHLKTXFN-UHFFFAOYSA-N
- Formula
- C15H24O
- SMILES
- CCCC(C)(C)CC(C)c1ccc(O)cc1
- Molecular Weight1
- 220.35
- 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° | 33.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -307.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.59 | kJ/mol | Joback Calculated Property |
| log10WS | -4.47 | Crippen Calculated Property | |
| logPoct/wat | 4.712 | Crippen Calculated Property | |
| McVol | 204.320 | ml/mol | McGowan Calculated Property |
| Pc | 2161.32 | kPa | Joback Calculated Property |
| Inp | [1715.00; 1715.00] |
|
|
| Inp | 1715.00 | NIST | |
| Inp | 1715.00 | NIST | |
| Inp | 1715.00 | NIST | |
| Tboil | 646.23 | K | Joback Calculated Property |
| Tc | 863.09 | K | Joback Calculated Property |
| Tfus | 384.37 | K | Joback Calculated Property |
| Vc | 0.717 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [560.90; 653.27] | J/mol×K | [646.23; 863.09] |
|
| Cp,gas | 560.90 | J/mol×K | 646.23 | Joback Calculated Property |
| Cp,gas | 578.81 | J/mol×K | 682.37 | Joback Calculated Property |
| Cp,gas | 595.55 | J/mol×K | 718.52 | Joback Calculated Property |
| Cp,gas | 611.26 | J/mol×K | 754.66 | Joback Calculated Property |
| Cp,gas | 626.04 | J/mol×K | 790.81 | Joback Calculated Property |
| Cp,gas | 640.01 | J/mol×K | 826.95 | Joback Calculated Property |
| Cp,gas | 653.27 | J/mol×K | 863.09 | Joback Calculated Property |
| η | [0.0000159; 0.0019247] | Pa×s | [384.37; 646.23] |
|
| η | 0.0019247 | Pa×s | 384.37 | Joback Calculated Property |
| η | 0.0005760 | Pa×s | 428.01 | Joback Calculated Property |
| η | 0.0002155 | Pa×s | 471.66 | Joback Calculated Property |
| η | 0.0000953 | Pa×s | 515.30 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 558.94 | Joback Calculated Property |
| η | 0.0000265 | Pa×s | 602.59 | Joback Calculated Property |
| η | 0.0000159 | Pa×s | 646.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 4-(1,3,3-trimethylhexyl).
Sources
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