- InChI
- InChI=1S/C8H7Cl3/c9-4-6-1-2-8(11)3-7(6)5-10/h1-3H,4-5H2
- InChI Key
- SBXAWQQSJQEERL-UHFFFAOYSA-N
- Formula
- C8H7Cl3
- SMILES
- ClCc1ccc(Cl)cc1CCl
- Molecular Weight1
- 209.50
- 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° | 73.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -42.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.16 | kJ/mol | Joback Calculated Property |
| log10WS | -4.22 | Crippen Calculated Property | |
| logPoct/wat | 3.818 | Crippen Calculated Property | |
| McVol | 136.540 | ml/mol | McGowan Calculated Property |
| Pc | 3100.18 | kPa | Joback Calculated Property |
| Inp | [1434.00; 1434.00] |
|
|
| Inp | 1434.00 | NIST | |
| Inp | 1434.00 | NIST | |
| Tboil | 531.37 | K | Joback Calculated Property |
| Tc | 762.04 | K | Joback Calculated Property |
| Tfus | 321.14 | K | Joback Calculated Property |
| Vc | 0.522 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [249.14; 299.43] | J/mol×K | [531.37; 762.04] |
|
| Cp,gas | 249.14 | J/mol×K | 531.37 | Joback Calculated Property |
| Cp,gas | 259.06 | J/mol×K | 569.82 | Joback Calculated Property |
| Cp,gas | 268.33 | J/mol×K | 608.26 | Joback Calculated Property |
| Cp,gas | 276.97 | J/mol×K | 646.71 | Joback Calculated Property |
| Cp,gas | 285.01 | J/mol×K | 685.15 | Joback Calculated Property |
| Cp,gas | 292.49 | J/mol×K | 723.60 | Joback Calculated Property |
| Cp,gas | 299.43 | J/mol×K | 762.04 | Joback Calculated Property |
| η | [0.0002670; 0.0017127] | Pa×s | [321.14; 531.37] |
|
| η | 0.0017127 | Pa×s | 321.14 | Joback Calculated Property |
| η | 0.0010789 | Pa×s | 356.18 | Joback Calculated Property |
| η | 0.0007383 | Pa×s | 391.22 | Joback Calculated Property |
| η | 0.0005378 | Pa×s | 426.25 | Joback Calculated Property |
| η | 0.0004110 | Pa×s | 461.29 | Joback Calculated Property |
| η | 0.0003263 | Pa×s | 496.33 | Joback Calculated Property |
| η | 0.0002670 | Pa×s | 531.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,2-bis-(chloromethyl)-4-chloro.
Sources
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