- InChI
- InChI=1S/C12H17Cl/c1-8-6-9(2)11(10(3)7-8)12(4,5)13/h6-7H,1-5H3
- InChI Key
- SEPLMBZJYZUXJF-UHFFFAOYSA-N
- Formula
- C12H17Cl
- SMILES
- Cc1cc(C)c(C(C)(C)Cl)c(C)c1
- Molecular Weight1
- 196.72
- 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).
- 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° | 124.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -113.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.66 | kJ/mol | Joback Calculated Property |
| log10WS | -4.44 | Crippen Calculated Property | |
| logPoct/wat | 4.086 | Crippen Calculated Property | |
| McVol | 168.420 | ml/mol | McGowan Calculated Property |
| Pc | 2263.26 | kPa | Joback Calculated Property |
| Inp | 1389.00 | NIST | |
| Tboil | 549.78 | K | Joback Calculated Property |
| Tc | 770.39 | K | Joback Calculated Property |
| Tfus | 321.32 | K | Joback Calculated Property |
| Vc | 0.637 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [379.95; 462.63] | J/mol×K | [549.78; 770.39] | 
|
| Cp,gas | 379.95 | J/mol×K | 549.78 | Joback Calculated Property |
| Cp,gas | 396.03 | J/mol×K | 586.55 | Joback Calculated Property |
| Cp,gas | 411.12 | J/mol×K | 623.32 | Joback Calculated Property |
| Cp,gas | 425.28 | J/mol×K | 660.09 | Joback Calculated Property |
| Cp,gas | 438.55 | J/mol×K | 696.85 | Joback Calculated Property |
| Cp,gas | 450.98 | J/mol×K | 733.62 | Joback Calculated Property |
| Cp,gas | 462.63 | J/mol×K | 770.39 | Joback Calculated Property |
| η | [0.0001790; 0.0016810] | Pa×s | [321.32; 549.78] |
|
| η | 0.0016810 | Pa×s | 321.32 | Joback Calculated Property |
| η | 0.0009497 | Pa×s | 359.40 | Joback Calculated Property |
| η | 0.0005985 | Pa×s | 397.47 | Joback Calculated Property |
| η | 0.0004089 | Pa×s | 435.55 | Joback Calculated Property |
| η | 0.0002970 | Pa×s | 473.63 | Joback Calculated Property |
| η | 0.0002263 | Pa×s | 511.70 | Joback Calculated Property |
| η | 0.0001790 | Pa×s | 549.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,3,5-trimethyl-2-(1-chloro-1-methylethyl).
Sources
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