- InChI
- InChI=1S/C10H12Cl2O/c1-7(2)13-6-8-5-9(11)3-4-10(8)12/h3-5,7H,6H2,1-2H3
- InChI Key
- RRTHUWMXLCHLTJ-UHFFFAOYSA-N
- Formula
- C10H12Cl2O
- SMILES
- CC(C)OCc1cc(Cl)ccc1Cl
- Molecular Weight1
- 219.11
- 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 | 0.4697 | Relay (1.0) Calculated Property | |
| ΔfG° | -4.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -219.11 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.59 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.57 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.37 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.918 | Crippen Calculated Property | |
| McVol | 158.350 | ml/mol | McGowan Calculated Property |
| Pc | 2603.08 | kPa | Joback Calculated Property |
| Inp | [1450.00; 1450.00] |
|
|
| Inp | 1450.00 | NIST | |
| Inp | 1450.00 | NIST | |
| Tboil | 517.92 | K | Relay (1.0) Calculated Property |
| Tc | 729.31 | K | Relay (1.0) Calculated Property |
| Tfus | 276.34 | K | Relay (1.0) Calculated Property |
| Vc | 0.574 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [335.81; 402.89] | J/mol×K | [561.68; 781.85] |
|
| Cp,gas | 335.81 | J/mol×K | 561.68 | Joback Calculated Property |
| Cp,gas | 348.74 | J/mol×K | 598.38 | Joback Calculated Property |
| Cp,gas | 360.96 | J/mol×K | 635.07 | Joback Calculated Property |
| Cp,gas | 372.47 | J/mol×K | 671.77 | Joback Calculated Property |
| Cp,gas | 383.28 | J/mol×K | 708.46 | Joback Calculated Property |
| Cp,gas | 393.42 | J/mol×K | 745.16 | Joback Calculated Property |
| Cp,gas | 402.89 | J/mol×K | 781.85 | Joback Calculated Property |
| η | [0.0001759; 0.0016690] | Pa×s | [320.99; 561.68] |
|
| η | 0.0016690 | Pa×s | 320.99 | Joback Calculated Property |
| η | 0.0009314 | Pa×s | 361.11 | Joback Calculated Property |
| η | 0.0005841 | Pa×s | 401.22 | Joback Calculated Property |
| η | 0.0003987 | Pa×s | 441.33 | Joback Calculated Property |
| η | 0.0002900 | Pa×s | 481.45 | Joback Calculated Property |
| η | 0.0002216 | Pa×s | 521.56 | Joback Calculated Property |
| η | 0.0001759 | Pa×s | 561.68 | Joback Calculated Property |
Similar Compounds
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Sources
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