- InChI
- InChI=1S/C10H13ClO/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7H,1-3H3
- InChI Key
- NEJWTQIEQDHWTR-UHFFFAOYSA-N
- Formula
- C10H13ClO
- SMILES
- CC(C)(C)Oc1ccc(Cl)cc1
- Molecular Weight1
- 184.66
- CAS
- 18995-35-2
- 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).
- 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° | 22.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -181.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.29 | kJ/mol | Joback Calculated Property |
| IE | 8.72 | eV | NIST |
| log10WS | -3.64 | Crippen Calculated Property | |
| logPoct/wat | 3.517 | Crippen Calculated Property | |
| McVol | 146.110 | ml/mol | McGowan Calculated Property |
| Pc | 2778.85 | kPa | Joback Calculated Property |
| Tboil | 516.48 | K | Joback Calculated Property |
| Tc | 740.03 | K | Joback Calculated Property |
| Tfus | 295.97 | K | Joback Calculated Property |
| Vc | 0.543 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [312.79; 387.72] | J/mol×K | [516.48; 740.03] | 
|
| Cp,gas | 312.79 | J/mol×K | 516.48 | Joback Calculated Property |
| Cp,gas | 327.51 | J/mol×K | 553.74 | Joback Calculated Property |
| Cp,gas | 341.29 | J/mol×K | 591.00 | Joback Calculated Property |
| Cp,gas | 354.15 | J/mol×K | 628.25 | Joback Calculated Property |
| Cp,gas | 366.15 | J/mol×K | 665.51 | Joback Calculated Property |
| Cp,gas | 377.32 | J/mol×K | 702.77 | Joback Calculated Property |
| Cp,gas | 387.72 | J/mol×K | 740.03 | Joback Calculated Property |
| η | [0.0001852; 0.0023736] | Pa×s | [295.97; 516.48] |
|
| η | 0.0023736 | Pa×s | 295.97 | Joback Calculated Property |
| η | 0.0012269 | Pa×s | 332.72 | Joback Calculated Property |
| η | 0.0007232 | Pa×s | 369.47 | Joback Calculated Property |
| η | 0.0004690 | Pa×s | 406.23 | Joback Calculated Property |
| η | 0.0003269 | Pa×s | 442.98 | Joback Calculated Property |
| η | 0.0002408 | Pa×s | 479.73 | Joback Calculated Property |
| η | 0.0001852 | Pa×s | 516.48 | Joback Calculated Property |
Similar Compounds
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Sources
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