- InChI
- InChI=1S/C11H16/c1-9(2)7-11-6-4-5-10(3)8-11/h4-6,8-9H,7H2,1-3H3
- InChI Key
- SDHYGAUOCHFYSR-UHFFFAOYSA-N
- Formula
- C11H16
- SMILES
- Cc1cccc(CC(C)C)c1
- Molecular Weight1
- 148.25
- Other Names
-
- 1-methyl-3-(2-methylpropy)benzene
- Benzene, 1-methyl-3-(2-methylpropyl)-
- Benzene, 1-methyl-3-isobutyl
- 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).
- I : 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 |
|---|---|---|---|
| ω | 0.4074 | Relay (1.0) Calculated Property | |
| ΔfG° | 142.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -57.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.53 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.194 | Crippen Calculated Property | |
| McVol | 142.090 | ml/mol | McGowan Calculated Property |
| Pc | 2629.85 | kPa | Joback Calculated Property |
| I | [1308.90; 1309.00] |
|
|
| I | 1308.90 | NIST | |
| I | 1309.00 | NIST | |
| I | 1309.00 | NIST | |
| I | 1309.00 | NIST | |
| Tboil | 469.58 | K | Relay (1.0) Calculated Property |
| Tc | 665.23 | K | Relay (1.0) Calculated Property |
| Tfus | 206.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.531 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [300.93; 385.28] | J/mol×K | [482.30; 690.17] |
|
| Cp,gas | 300.93 | J/mol×K | 482.30 | Joback Calculated Property |
| Cp,gas | 317.03 | J/mol×K | 516.94 | Joback Calculated Property |
| Cp,gas | 332.27 | J/mol×K | 551.59 | Joback Calculated Property |
| Cp,gas | 346.68 | J/mol×K | 586.23 | Joback Calculated Property |
| Cp,gas | 360.30 | J/mol×K | 620.88 | Joback Calculated Property |
| Cp,gas | 373.16 | J/mol×K | 655.52 | Joback Calculated Property |
| Cp,gas | 385.28 | J/mol×K | 690.17 | Joback Calculated Property |
| η | [0.0001987; 0.0036688] | Pa×s | [237.67; 482.30] |
|
| η | 0.0036688 | Pa×s | 237.67 | Joback Calculated Property |
| η | 0.0015812 | Pa×s | 278.44 | Joback Calculated Property |
| η | 0.0008449 | Pa×s | 319.21 | Joback Calculated Property |
| η | 0.0005204 | Pa×s | 359.99 | Joback Calculated Property |
| η | 0.0003537 | Pa×s | 400.76 | Joback Calculated Property |
| η | 0.0002582 | Pa×s | 441.53 | Joback Calculated Property |
| η | 0.0001987 | Pa×s | 482.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-methyl-3-(2-methylpropyl)-.
Sources
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