- InChI
- InChI=1S/C6H11ClO/c1-5(8)6(2,3)4-7/h4H2,1-3H3
- InChI Key
- ZTIQUSIDVGYUBW-UHFFFAOYSA-N
- Formula
- C6H11ClO
- SMILES
- CC(=O)C(C)(C)CCl
- Molecular Weight1
- 134.60
- 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 | 0.3319 | Relay (... Calculated Property | |
| ΔfG° | -138.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -337.75 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 9.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.86 | kJ/mol | Relay (... Calculated Property |
| IE | 9.56 | eV | Relay (... Calculated Property |
| log10WS | -1.29 | Relay (... Calculated Property | |
| logPoct/wat | 1.840 | Crippen Calculated Property | |
| McVol | 109.210 | ml/mol | McGowan Calculated Property |
| Pc | 3269.04 | kPa | Joback Calculated Property |
| Inp | [904.00; 904.00] |
|
|
| Inp | 904.00 | NIST | |
| Inp | 904.00 | NIST | |
| Tboil | 434.68 | K | Relay (... Calculated Property |
| Tc | 637.16 | K | Relay (... Calculated Property |
| Tfus | 264.71 | K | Relay (... Calculated Property |
| Vc | 0.381 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [205.61; 262.82] | J/mol×K | [424.75; 622.09] |
|
| Cp,gas | 205.61 | J/mol×K | 424.75 | Joback Calculated Property |
| Cp,gas | 216.65 | J/mol×K | 457.64 | Joback Calculated Property |
| Cp,gas | 227.04 | J/mol×K | 490.53 | Joback Calculated Property |
| Cp,gas | 236.83 | J/mol×K | 523.42 | Joback Calculated Property |
| Cp,gas | 246.04 | J/mol×K | 556.31 | Joback Calculated Property |
| Cp,gas | 254.69 | J/mol×K | 589.20 | Joback Calculated Property |
| Cp,gas | 262.82 | J/mol×K | 622.09 | Joback Calculated Property |
| η | [0.0003699; 0.0060123] | Pa×s | [239.65; 424.75] |
|
| η | 0.0060123 | Pa×s | 239.65 | Joback Calculated Property |
| η | 0.0028981 | Pa×s | 270.50 | Joback Calculated Property |
| η | 0.0016221 | Pa×s | 301.35 | Joback Calculated Property |
| η | 0.0010112 | Pa×s | 332.20 | Joback Calculated Property |
| η | 0.0006831 | Pa×s | 363.05 | Joback Calculated Property |
| η | 0.0004907 | Pa×s | 393.90 | Joback Calculated Property |
| η | 0.0003699 | Pa×s | 424.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Butanone, 4-chloro-3,3-dimethyl.
Sources
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