- InChI
- InChI=1S/C12H18/c1-3-5-7-12-9-6-8-11(4-2)10-12/h6,8-10H,3-5,7H2,1-2H3
- InChI Key
- IBQJOCAGNFEEKY-UHFFFAOYSA-N
- Formula
- C12H18
- SMILES
- CCCCc1cccc(CC)c1
- Molecular Weight1
- 162.27
- Other Names
-
- 1-Ethyl-3-n-Butylbenzene
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 152.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -65.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.24 | kJ/mol | Joback Calculated Property |
| log10WS | -3.91 | Crippen Calculated Property | |
| logPoct/wat | 3.592 | Crippen Calculated Property | |
| McVol | 156.180 | ml/mol | McGowan Calculated Property |
| Pc | 2370.28 | kPa | Joback Calculated Property |
| I | [1422.60; 1423.00] |
|
|
| I | 1422.60 | NIST | |
| I | 1423.00 | NIST | |
| I | 1423.00 | NIST | |
| Tboil | 505.62 | K | Joback Calculated Property |
| Tc | 706.05 | K | Joback Calculated Property |
| Tfus | 263.94 | K | Joback Calculated Property |
| Vc | 0.600 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [346.19; 433.10] | J/mol×K | [505.62; 706.05] |
|
| Cp,gas | 346.19 | J/mol×K | 505.62 | Joback Calculated Property |
| Cp,gas | 362.69 | J/mol×K | 539.02 | Joback Calculated Property |
| Cp,gas | 378.35 | J/mol×K | 572.43 | Joback Calculated Property |
| Cp,gas | 393.19 | J/mol×K | 605.83 | Joback Calculated Property |
| Cp,gas | 407.24 | J/mol×K | 639.24 | Joback Calculated Property |
| Cp,gas | 420.54 | J/mol×K | 672.64 | Joback Calculated Property |
| Cp,gas | 433.10 | J/mol×K | 706.05 | Joback Calculated Property |
| η | [0.0002000; 0.0026290] | Pa×s | [263.94; 505.62] |
|
| η | 0.0026290 | Pa×s | 263.94 | Joback Calculated Property |
| η | 0.0012879 | Pa×s | 304.22 | Joback Calculated Property |
| η | 0.0007455 | Pa×s | 344.50 | Joback Calculated Property |
| η | 0.0004839 | Pa×s | 384.78 | Joback Calculated Property |
| η | 0.0003409 | Pa×s | 425.06 | Joback Calculated Property |
| η | 0.0002551 | Pa×s | 465.34 | Joback Calculated Property |
| η | 0.0002000 | Pa×s | 505.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-ethyl-3-butyl.
Sources
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