- InChI
- InChI=1S/C9H10Cl2O/c1-2-12-6-7-3-4-8(10)5-9(7)11/h3-5H,2,6H2,1H3
- InChI Key
- KBMWRDHROVTFDI-UHFFFAOYSA-N
- Formula
- C9H10Cl2O
- SMILES
- CCOCc1ccc(Cl)cc1Cl
- Molecular Weight1
- 205.08
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.4579 | Relay (1.0) Calculated Property | |
| ΔfG° | -10.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -187.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 21.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.58 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.530 | Crippen Calculated Property | |
| McVol | 144.260 | ml/mol | McGowan Calculated Property |
| Pc | 2853.57 | kPa | Joback Calculated Property |
| Inp | [1363.00; 1377.00] |
|
|
| Inp | 1367.00 | NIST | |
| Inp | 1370.00 | NIST | |
| Inp | 1371.00 | NIST | |
| Inp | 1372.00 | NIST | |
| Inp | 1373.00 | NIST | |
| Inp | 1373.00 | NIST | |
| Inp | 1374.00 | NIST | |
| Inp | 1377.00 | NIST | |
| Inp | 1363.00 | NIST | |
| Inp | 1365.00 | NIST | |
| Inp | 1366.00 | NIST | |
| Inp | 1368.00 | NIST | |
| Inp | 1367.00 | NIST | |
| Inp | 1373.00 | NIST | |
| Inp | 1366.00 | NIST | |
| Tboil | 515.51 | K | Relay (1.0) Calculated Property |
| Tc | 726.98 | K | Relay (1.0) Calculated Property |
| Tfus | 264.68 | K | Relay (1.0) Calculated Property |
| Vc | 0.517 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [290.67; 351.13] | J/mol×K | [539.24; 758.44] |
|
| Cp,gas | 290.67 | J/mol×K | 539.24 | Joback Calculated Property |
| Cp,gas | 302.27 | J/mol×K | 575.77 | Joback Calculated Property |
| Cp,gas | 313.24 | J/mol×K | 612.31 | Joback Calculated Property |
| Cp,gas | 323.60 | J/mol×K | 648.84 | Joback Calculated Property |
| Cp,gas | 333.37 | J/mol×K | 685.37 | Joback Calculated Property |
| Cp,gas | 342.54 | J/mol×K | 721.91 | Joback Calculated Property |
| Cp,gas | 351.13 | J/mol×K | 758.44 | Joback Calculated Property |
| η | [0.0002037; 0.0013666] | Pa×s | [324.72; 539.24] |
|
| η | 0.0013666 | Pa×s | 324.72 | Joback Calculated Property |
| η | 0.0008503 | Pa×s | 360.47 | Joback Calculated Property |
| η | 0.0005763 | Pa×s | 396.23 | Joback Calculated Property |
| η | 0.0004166 | Pa×s | 431.98 | Joback Calculated Property |
| η | 0.0003165 | Pa×s | 467.73 | Joback Calculated Property |
| η | 0.0002500 | Pa×s | 503.49 | Joback Calculated Property |
| η | 0.0002037 | Pa×s | 539.24 | Joback Calculated Property |
Similar Compounds
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Sources
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