- InChI
- InChI=1S/C8H7Cl3/c9-8(10,11)6-7-4-2-1-3-5-7/h1-5H,6H2
- InChI Key
- XFEKIQFBJSDMQB-UHFFFAOYSA-N
- Formula
- C8H7Cl3
- SMILES
- ClC(Cl)(Cl)Cc1ccccc1
- Molecular Weight1
- 209.50
- CAS
- 3883-13-4
- 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° | 95.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -27.89 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.54 | kJ/mol | Joback Calculated Property |
| log10WS | -3.84 | Crippen Calculated Property | |
| logPoct/wat | 3.599 | Crippen Calculated Property | |
| McVol | 136.540 | ml/mol | McGowan Calculated Property |
| Pc | 3276.53 | kPa | Joback Calculated Property |
| Inp | [1279.00; 1301.00] |
|
|
| Inp | 1301.00 | NIST | |
| Inp | 1279.00 | NIST | |
| Inp | 1301.00 | NIST | |
| Tboil | 518.18 | K | Joback Calculated Property |
| Tc | 762.22 | K | Joback Calculated Property |
| Tfus | 298.52 | K | Joback Calculated Property |
| Vc | 0.511 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [254.16; 309.17] | J/mol×K | [518.18; 762.22] |
|
| Cp,gas | 254.16 | J/mol×K | 518.18 | Joback Calculated Property |
| Cp,gas | 265.75 | J/mol×K | 558.85 | Joback Calculated Property |
| Cp,gas | 276.25 | J/mol×K | 599.53 | Joback Calculated Property |
| Cp,gas | 285.76 | J/mol×K | 640.20 | Joback Calculated Property |
| Cp,gas | 294.36 | J/mol×K | 680.87 | Joback Calculated Property |
| Cp,gas | 302.14 | J/mol×K | 721.54 | Joback Calculated Property |
| Cp,gas | 309.17 | J/mol×K | 762.22 | Joback Calculated Property |
| η | [0.0002703; 0.0037480] | Pa×s | [298.52; 518.18] |
|
| η | 0.0037480 | Pa×s | 298.52 | Joback Calculated Property |
| η | 0.0019034 | Pa×s | 335.13 | Joback Calculated Property |
| η | 0.0011046 | Pa×s | 371.74 | Joback Calculated Property |
| η | 0.0007068 | Pa×s | 408.35 | Joback Calculated Property |
| η | 0.0004867 | Pa×s | 444.96 | Joback Calculated Property |
| η | 0.0003547 | Pa×s | 481.57 | Joback Calculated Property |
| η | 0.0002703 | Pa×s | 518.18 | Joback Calculated Property |
Similar Compounds
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Sources
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