- InChI
- InChI=1S/C6H11ClO/c1-4(2)6(8)5(3)7/h4-5H,1-3H3
- InChI Key
- YZZGXNYEUGNGFC-UHFFFAOYSA-N
- Formula
- C6H11ClO
- SMILES
- CC(C)C(=O)C(C)Cl
- Molecular Weight1
- 134.60
- 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° | -146.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -306.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.31 | kJ/mol | Joback Calculated Property |
| log10WS | -1.64 | Crippen Calculated Property | |
| logPoct/wat | 1.839 | Crippen Calculated Property | |
| McVol | 109.210 | ml/mol | McGowan Calculated Property |
| Pc | 3257.86 | kPa | Joback Calculated Property |
| Inp | [847.00; 847.00] |
|
|
| Inp | 847.00 | NIST | |
| Inp | 847.00 | NIST | |
| Tboil | 427.10 | K | Joback Calculated Property |
| Tc | 620.79 | K | Joback Calculated Property |
| Tfus | 207.23 | K | Joback Calculated Property |
| Vc | 0.414 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [203.33; 259.15] | J/mol×K | [427.10; 620.79] |
|
| Cp,gas | 203.33 | J/mol×K | 427.10 | Joback Calculated Property |
| Cp,gas | 213.79 | J/mol×K | 459.38 | Joback Calculated Property |
| Cp,gas | 223.77 | J/mol×K | 491.66 | Joback Calculated Property |
| Cp,gas | 233.28 | J/mol×K | 523.94 | Joback Calculated Property |
| Cp,gas | 242.34 | J/mol×K | 556.23 | Joback Calculated Property |
| Cp,gas | 250.96 | J/mol×K | 588.51 | Joback Calculated Property |
| Cp,gas | 259.15 | J/mol×K | 620.79 | Joback Calculated Property |
| η | [0.0003215; 0.0096323] | Pa×s | [207.23; 427.10] |
|
| η | 0.0096323 | Pa×s | 207.23 | Joback Calculated Property |
| η | 0.0035708 | Pa×s | 243.88 | Joback Calculated Property |
| η | 0.0017155 | Pa×s | 280.52 | Joback Calculated Property |
| η | 0.0009763 | Pa×s | 317.17 | Joback Calculated Property |
| η | 0.0006245 | Pa×s | 353.81 | Joback Calculated Property |
| η | 0.0004344 | Pa×s | 390.46 | Joback Calculated Property |
| η | 0.0003215 | Pa×s | 427.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Pentanone, 4-chloro-2-methyl.
Sources
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