- InChI
- InChI=1S/C10H14O/c1-8(2)7-9-3-5-10(11)6-4-9/h3-6,8,11H,7H2,1-2H3
- InChI Key
- GDEHXPCZWFXRKC-UHFFFAOYSA-N
- Formula
- C10H14O
- SMILES
- CC(C)Cc1ccc(O)cc1
- Molecular Weight1
- 150.22
- CAS
- 4167-74-2
- Other Names
-
- 4-Isobutylphenol
- Phenol, p-isobutyl-
- p-Isobutylphenol
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Pvap : Vapor 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° | -11.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -195.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.76 | kJ/mol | Joback Calculated Property |
| log10WS | -2.42 | Crippen Calculated Property | |
| logPoct/wat | 2.591 | Crippen Calculated Property | |
| McVol | 133.870 | ml/mol | McGowan Calculated Property |
| Pc | 3501.28 | kPa | Joback Calculated Property |
| Inp | [1279.00; 1287.00] |
|
|
| Inp | 1279.00 | NIST | |
| Inp | 1287.00 | NIST | |
| Tboil | [510.15; 519.15] | K |
|
| Tboil | 519.15 ± 3.00 | K | NIST |
| Tboil | 510.15 ± 3.00 | K | NIST |
| Tboil | 510.15 ± 3.00 | K | NIST |
| Tc | 758.39 | K | Joback Calculated Property |
| Tfus | [321.15; 324.65] | K |
|
| Tfus | 321.15 ± 4.00 | K | NIST |
| Tfus | 324.65 ± 2.00 | K | NIST |
| Vc | 0.448 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [311.88; 384.11] | J/mol×K | [535.06; 758.39] |
|
| Cp,gas | 311.88 | J/mol×K | 535.06 | Joback Calculated Property |
| Cp,gas | 326.10 | J/mol×K | 572.28 | Joback Calculated Property |
| Cp,gas | 339.34 | J/mol×K | 609.50 | Joback Calculated Property |
| Cp,gas | 351.67 | J/mol×K | 646.73 | Joback Calculated Property |
| Cp,gas | 363.20 | J/mol×K | 683.95 | Joback Calculated Property |
| Cp,gas | 373.98 | J/mol×K | 721.17 | Joback Calculated Property |
| Cp,gas | 384.11 | J/mol×K | 758.39 | Joback Calculated Property |
| η | [0.0000572; 0.0057625] | Pa×s | [325.60; 535.06] |
|
| η | 0.0057625 | Pa×s | 325.60 | Joback Calculated Property |
| η | 0.0018414 | Pa×s | 360.51 | Joback Calculated Property |
| η | 0.0007197 | Pa×s | 395.42 | Joback Calculated Property |
| η | 0.0003276 | Pa×s | 430.33 | Joback Calculated Property |
| η | 0.0001678 | Pa×s | 465.24 | Joback Calculated Property |
| η | 0.0000944 | Pa×s | 500.15 | Joback Calculated Property |
| η | 0.0000572 | Pa×s | 535.06 | Joback Calculated Property |
| ΔvapH | 58.10 | kJ/mol | 427.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [388.12; 539.36] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.54478e+01 | |||
| Coefficient B | -4.62610e+03 | |||
| Coefficient C | -8.29720e+01 | |||
| Temperature range, min. | 388.12 | |||
| Temperature range, max. | 539.36 | |||
| Pvap | 1.33 | kPa | 388.12 | Calculated Property |
| Pvap | 2.94 | kPa | 404.92 | Calculated Property |
| Pvap | 6.00 | kPa | 421.73 | Calculated Property |
| Pvap | 11.44 | kPa | 438.53 | Calculated Property |
| Pvap | 20.58 | kPa | 455.34 | Calculated Property |
| Pvap | 35.19 | kPa | 472.14 | Calculated Property |
| Pvap | 57.55 | kPa | 488.95 | Calculated Property |
| Pvap | 90.53 | kPa | 505.75 | Calculated Property |
| Pvap | 137.54 | kPa | 522.56 | Calculated Property |
| Pvap | 202.64 | kPa | 539.36 | Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 4-(2-methylpropyl)-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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