- InChI
- InChI=1S/C12H16Cl2/c1-8(2)10-5-4-9(3)11(6-13)12(10)7-14/h4-5,8H,6-7H2,1-3H3
- InChI Key
- MBKXFZDCNSTKSD-UHFFFAOYSA-N
- Formula
- C12H16Cl2
- SMILES
- Cc1ccc(C(C)C)c(CCl)c1CCl
- Molecular Weight1
- 231.16
- 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° | 107.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -125.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.95 | kJ/mol | Joback Calculated Property |
| log10WS | -5.20 | Crippen Calculated Property | |
| logPoct/wat | 4.596 | Crippen Calculated Property | |
| McVol | 180.660 | ml/mol | McGowan Calculated Property |
| Pc | 2163.33 | kPa | Joback Calculated Property |
| Inp | [1670.00; 1670.00] |
|
|
| Inp | 1670.00 | NIST | |
| Inp | 1670.00 | NIST | |
| Tboil | 590.00 | K | Joback Calculated Property |
| Tc | 806.13 | K | Joback Calculated Property |
| Tfus | 333.82 | K | Joback Calculated Property |
| Vc | 0.692 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [404.98; 480.80] | J/mol×K | [590.00; 806.13] |
|
| Cp,gas | 404.98 | J/mol×K | 590.00 | Joback Calculated Property |
| Cp,gas | 419.57 | J/mol×K | 626.02 | Joback Calculated Property |
| Cp,gas | 433.34 | J/mol×K | 662.04 | Joback Calculated Property |
| Cp,gas | 446.32 | J/mol×K | 698.06 | Joback Calculated Property |
| Cp,gas | 458.54 | J/mol×K | 734.09 | Joback Calculated Property |
| Cp,gas | 470.03 | J/mol×K | 770.11 | Joback Calculated Property |
| Cp,gas | 480.80 | J/mol×K | 806.13 | Joback Calculated Property |
| η | [0.0001789; 0.0016337] | Pa×s | [333.82; 590.00] |
|
| η | 0.0016337 | Pa×s | 333.82 | Joback Calculated Property |
| η | 0.0009168 | Pa×s | 376.52 | Joback Calculated Property |
| η | 0.0005788 | Pa×s | 419.21 | Joback Calculated Property |
| η | 0.0003978 | Pa×s | 461.91 | Joback Calculated Property |
| η | 0.0002913 | Pa×s | 504.61 | Joback Calculated Property |
| η | 0.0002240 | Pa×s | 547.30 | Joback Calculated Property |
| η | 0.0001789 | Pa×s | 590.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Methyl-4-(1-methylethyl)-2,3-bis(chloromethyl)benzene.
Sources
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