- InChI
- InChI=1S/C11H16/c1-9-7-5-6-8-10(9)11(2,3)4/h5-8H,1-4H3
- InChI Key
- AXHVNJGQOJFMHT-UHFFFAOYSA-N
- Formula
- C11H16
- SMILES
- Cc1ccccc1C(C)(C)C
- Molecular Weight1
- 148.25
- Other Names
-
- 1-Methyl-2-tert-butylbenzene
- 1-tert-Butyl-2-methylbenzene
- 2-t-Butyltoluene
- Benzene, 1-(1,1-dimethylethyl)-2-methyl-
- Toluene, o-tert-butyl-
- o-t-Butyltoluene
- o-tert-Butyltoluene
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.3295 | Relay (1.0) Calculated Property | |
| ΔfG° | 147.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -43.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 10.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.27 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.293 | Crippen Calculated Property | |
| McVol | 142.090 | ml/mol | McGowan Calculated Property |
| Pc | 2659.77 | kPa | Joback Calculated Property |
| Tboil | 466.40 | K | Relay (1.0) Calculated Property |
| Tc | 671.75 | K | Relay (1.0) Calculated Property |
| Tfus | 210.52 | K | Relay (1.0) Calculated Property |
| Vc | 0.518 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [303.63; 390.85] | J/mol×K | [479.71; 696.60] | 
|
| Cp,gas | 303.63 | J/mol×K | 479.71 | Joback Calculated Property |
| Cp,gas | 320.68 | J/mol×K | 515.86 | Joback Calculated Property |
| Cp,gas | 336.66 | J/mol×K | 552.01 | Joback Calculated Property |
| Cp,gas | 351.61 | J/mol×K | 588.16 | Joback Calculated Property |
| Cp,gas | 365.59 | J/mol×K | 624.31 | Joback Calculated Property |
| Cp,gas | 378.65 | J/mol×K | 660.45 | Joback Calculated Property |
| Cp,gas | 390.85 | J/mol×K | 696.60 | Joback Calculated Property |
| η | [0.0002064; 0.0036767] | Pa×s | [255.09; 479.71] |
|
| η | 0.0036767 | Pa×s | 255.09 | Joback Calculated Property |
| η | 0.0016735 | Pa×s | 292.53 | Joback Calculated Property |
| η | 0.0009107 | Pa×s | 329.96 | Joback Calculated Property |
| η | 0.0005610 | Pa×s | 367.40 | Joback Calculated Property |
| η | 0.0003780 | Pa×s | 404.84 | Joback Calculated Property |
| η | 0.0002723 | Pa×s | 442.27 | Joback Calculated Property |
| η | 0.0002064 | Pa×s | 479.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to BENZENE, 1-(1,1-DIMETHYLETHYL)-2-METHYL-.
Sources
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