- InChI
- InChI=1S/C9H13Cl3/c10-9(11,12)8-6-4-2-1-3-5-7-8/h6H,1-5,7H2/b8-6+
- InChI Key
- FCFMGYWICYEEAL-SOFGYWHQSA-N
- Formula
- C9H13Cl3
- SMILES
- ClC(Cl)(Cl)C1=CCCCCCC1
- Molecular Weight1
- 227.56
- 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° | 20.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -176.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.52 | kJ/mol | Joback Calculated Property |
| log10WS | -4.90 | Crippen Calculated Property | |
| logPoct/wat | 4.637 | Crippen Calculated Property | |
| McVol | 159.230 | ml/mol | McGowan Calculated Property |
| Pc | 2875.03 | kPa | Joback Calculated Property |
| Inp | [1464.00; 1464.00] |
|
|
| Inp | 1464.00 | NIST | |
| Inp | 1464.00 | NIST | |
| Tboil | 551.28 | K | Joback Calculated Property |
| Tc | 803.72 | K | Joback Calculated Property |
| Tfus | 301.23 | K | Joback Calculated Property |
| Vc | 0.580 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [335.00; 419.04] | J/mol×K | [551.28; 803.72] |
|
| Cp,gas | 335.00 | J/mol×K | 551.28 | Joback Calculated Property |
| Cp,gas | 352.25 | J/mol×K | 593.35 | Joback Calculated Property |
| Cp,gas | 368.11 | J/mol×K | 635.43 | Joback Calculated Property |
| Cp,gas | 382.65 | J/mol×K | 677.50 | Joback Calculated Property |
| Cp,gas | 395.94 | J/mol×K | 719.58 | Joback Calculated Property |
| Cp,gas | 408.04 | J/mol×K | 761.65 | Joback Calculated Property |
| Cp,gas | 419.04 | J/mol×K | 803.72 | Joback Calculated Property |
| η | [0.0001453; 0.0069043] | Pa×s | [301.23; 551.28] |
|
| η | 0.0069043 | Pa×s | 301.23 | Joback Calculated Property |
| η | 0.0024538 | Pa×s | 342.91 | Joback Calculated Property |
| η | 0.0010913 | Pa×s | 384.58 | Joback Calculated Property |
| η | 0.0005686 | Pa×s | 426.25 | Joback Calculated Property |
| η | 0.0003328 | Pa×s | 467.93 | Joback Calculated Property |
| η | 0.0002126 | Pa×s | 509.60 | Joback Calculated Property |
| η | 0.0001453 | Pa×s | 551.28 | Joback Calculated Property |
Similar Compounds
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Sources
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