- InChI
- InChI=1S/C13H19Cl/c1-8(2)13-10(4)6-9(3)12(7-14)11(13)5/h6,8H,7H2,1-5H3
- InChI Key
- QUTXJFLYNDTENY-UHFFFAOYSA-N
- Formula
- C13H19Cl
- SMILES
- Cc1cc(C)c(C(C)C)c(C)c1CCl
- Molecular Weight1
- 210.74
- 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° | 118.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -142.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.45 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.474 | Crippen Calculated Property | |
| McVol | 182.510 | ml/mol | McGowan Calculated Property |
| Pc | 2021.76 | kPa | Joback Calculated Property |
| Inp | [1602.00; 1602.00] |
|
|
| Inp | 1602.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Tboil | 580.43 | K | Joback Calculated Property |
| Tc | 790.00 | K | Joback Calculated Property |
| Tfus | 327.69 | K | Joback Calculated Property |
| Vc | 0.699 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [424.98; 509.04] | J/mol×K | [580.43; 790.00] |
|
| Cp,gas | 424.98 | J/mol×K | 580.43 | Joback Calculated Property |
| Cp,gas | 440.91 | J/mol×K | 615.36 | Joback Calculated Property |
| Cp,gas | 456.05 | J/mol×K | 650.29 | Joback Calculated Property |
| Cp,gas | 470.41 | J/mol×K | 685.21 | Joback Calculated Property |
| Cp,gas | 484.02 | J/mol×K | 720.14 | Joback Calculated Property |
| Cp,gas | 496.89 | J/mol×K | 755.07 | Joback Calculated Property |
| Cp,gas | 509.04 | J/mol×K | 790.00 | Joback Calculated Property |
| η | [0.0001656; 0.0013374] | Pa×s | [327.69; 580.43] |
|
| η | 0.0013374 | Pa×s | 327.69 | Joback Calculated Property |
| η | 0.0007744 | Pa×s | 369.81 | Joback Calculated Property |
| η | 0.0005014 | Pa×s | 411.94 | Joback Calculated Property |
| η | 0.0003519 | Pa×s | 454.06 | Joback Calculated Property |
| η | 0.0002623 | Pa×s | 496.18 | Joback Calculated Property |
| η | 0.0002047 | Pa×s | 538.31 | Joback Calculated Property |
| η | 0.0001656 | Pa×s | 580.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-Trimethyl-2-(1-methylethyl)-4-(chloromethyl)benzene.
Sources
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