- InChI
- InChI=1S/C13H18O/c1-5-7-10-8-6-9-11(12(10)14)13(2,3)4/h5-6,8-9,14H,1,7H2,2-4H3
- InChI Key
- JHCFLUGYQKACEJ-UHFFFAOYSA-N
- Formula
- C13H18O
- SMILES
- C=CCc1cccc(C(C)(C)C)c1O
- Molecular Weight1
- 190.28
- CAS
- 3354-55-0
- 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° | 97.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -147.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.52 | kJ/mol | Joback Calculated Property |
| log10WS | -3.41 | Crippen Calculated Property | |
| logPoct/wat | 3.418 | Crippen Calculated Property | |
| McVol | 171.840 | ml/mol | McGowan Calculated Property |
| Pc | 2657.03 | kPa | Joback Calculated Property |
| Tboil | 602.57 | K | Joback Calculated Property |
| Tc | 828.31 | K | Joback Calculated Property |
| Tfus | 387.59 | K | Joback Calculated Property |
| Vc | 0.592 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [436.38; 516.82] | J/mol×K | [602.57; 828.31] | 
|
| Cp,gas | 436.38 | J/mol×K | 602.57 | Joback Calculated Property |
| Cp,gas | 452.19 | J/mol×K | 640.19 | Joback Calculated Property |
| Cp,gas | 466.88 | J/mol×K | 677.82 | Joback Calculated Property |
| Cp,gas | 480.57 | J/mol×K | 715.44 | Joback Calculated Property |
| Cp,gas | 493.38 | J/mol×K | 753.07 | Joback Calculated Property |
| Cp,gas | 505.43 | J/mol×K | 790.69 | Joback Calculated Property |
| Cp,gas | 516.82 | J/mol×K | 828.31 | Joback Calculated Property |
| η | [0.0000278; 0.0013350] | Pa×s | [387.59; 602.57] |
|
| η | 0.0013350 | Pa×s | 387.59 | Joback Calculated Property |
| η | 0.0005331 | Pa×s | 423.42 | Joback Calculated Property |
| η | 0.0002457 | Pa×s | 459.25 | Joback Calculated Property |
| η | 0.0001266 | Pa×s | 495.08 | Joback Calculated Property |
| η | 0.0000714 | Pa×s | 530.91 | Joback Calculated Property |
| η | 0.0000433 | Pa×s | 566.74 | Joback Calculated Property |
| η | 0.0000278 | Pa×s | 602.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Allyl-6-t-butylphenol.
Sources
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