- InChI
- InChI=1S/C12H15ClO/c1-4-9-5-7-10(8-6-9)11(14)12(2,3)13/h5-8H,4H2,1-3H3
- InChI Key
- JRCYBVHLGNUGDA-UHFFFAOYSA-N
- Formula
- C12H15ClO
- SMILES
- CCc1ccc(C(=O)C(C)(C)Cl)cc1
- Molecular Weight1
- 210.70
- CAS
- 55012-69-6
- Other Names
-
- 2-Chloro-1-(4-ethylphenyl)-2-methyl-1-propanone
- 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).
- 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° | 14.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -203.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.08 | kJ/mol | Joback Calculated Property |
| log10WS | -4.04 | Crippen Calculated Property | |
| logPoct/wat | 3.449 | Crippen Calculated Property | |
| McVol | 169.990 | ml/mol | McGowan Calculated Property |
| Pc | 2477.65 | kPa | Joback Calculated Property |
| Tboil | 593.69 | K | Joback Calculated Property |
| Tc | 820.05 | K | Joback Calculated Property |
| Tfus | 346.21 | K | Joback Calculated Property |
| Vc | 0.643 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [399.66; 475.42] | J/mol×K | [593.69; 820.05] | 
|
| Cp,gas | 399.66 | J/mol×K | 593.69 | Joback Calculated Property |
| Cp,gas | 414.77 | J/mol×K | 631.42 | Joback Calculated Property |
| Cp,gas | 428.81 | J/mol×K | 669.14 | Joback Calculated Property |
| Cp,gas | 441.82 | J/mol×K | 706.87 | Joback Calculated Property |
| Cp,gas | 453.88 | J/mol×K | 744.60 | Joback Calculated Property |
| Cp,gas | 465.06 | J/mol×K | 782.33 | Joback Calculated Property |
| Cp,gas | 475.42 | J/mol×K | 820.05 | Joback Calculated Property |
| η | [0.0001947; 0.0023840] | Pa×s | [346.21; 593.69] |
|
| η | 0.0023840 | Pa×s | 346.21 | Joback Calculated Property |
| η | 0.0012574 | Pa×s | 387.46 | Joback Calculated Property |
| η | 0.0007500 | Pa×s | 428.70 | Joback Calculated Property |
| η | 0.0004899 | Pa×s | 469.95 | Joback Calculated Property |
| η | 0.0003427 | Pa×s | 511.20 | Joback Calculated Property |
| η | 0.0002529 | Pa×s | 552.44 | Joback Calculated Property |
| η | 0.0001947 | Pa×s | 593.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propanone, 2-chloro-1-(4-ethylphenyl)-2-methyl-.
Sources
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