- InChI
- InChI=1S/C13H9Cl3/c14-11-4-1-9(2-5-11)7-10-3-6-12(15)13(16)8-10/h1-6,8H,7H2
- InChI Key
- GMTGVYQVNHYBFQ-UHFFFAOYSA-N
- Formula
- C13H9Cl3
- SMILES
- Clc1ccc(Cc2ccc(Cl)c(Cl)c2)cc1
- Molecular Weight1
- 271.57
- 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° | 218.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 79.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.22 | kJ/mol | Joback Calculated Property |
| log10WS | -5.63 | Crippen Calculated Property | |
| logPoct/wat | 5.238 | Crippen Calculated Property | |
| McVol | 183.230 | ml/mol | McGowan Calculated Property |
| Pc | 2603.08 | kPa | Joback Calculated Property |
| Inp | [342.10; 342.10] |
|
|
| Inp | 342.10 | NIST | |
| Inp | 342.10 | NIST | |
| Tboil | 677.43 | K | Joback Calculated Property |
| Tc | 934.55 | K | Joback Calculated Property |
| Tfus | 416.43 | K | Joback Calculated Property |
| Vc | 0.695 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [397.62; 457.98] | J/mol×K | [677.43; 934.55] |
|
| Cp,gas | 397.62 | J/mol×K | 677.43 | Joback Calculated Property |
| Cp,gas | 410.10 | J/mol×K | 720.28 | Joback Calculated Property |
| Cp,gas | 421.52 | J/mol×K | 763.14 | Joback Calculated Property |
| Cp,gas | 431.95 | J/mol×K | 805.99 | Joback Calculated Property |
| Cp,gas | 441.46 | J/mol×K | 848.84 | Joback Calculated Property |
| Cp,gas | 450.11 | J/mol×K | 891.69 | Joback Calculated Property |
| Cp,gas | 457.98 | J/mol×K | 934.55 | Joback Calculated Property |
| η | [0.0001671; 0.0010257] | Pa×s | [416.43; 677.43] |
|
| η | 0.0010257 | Pa×s | 416.43 | Joback Calculated Property |
| η | 0.0006570 | Pa×s | 459.93 | Joback Calculated Property |
| η | 0.0004545 | Pa×s | 503.43 | Joback Calculated Property |
| η | 0.0003334 | Pa×s | 546.93 | Joback Calculated Property |
| η | 0.0002559 | Pa×s | 590.43 | Joback Calculated Property |
| η | 0.0002038 | Pa×s | 633.93 | Joback Calculated Property |
| η | 0.0001671 | Pa×s | 677.43 | Joback Calculated Property |
Similar Compounds
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Sources
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