- InChI
- InChI=1S/C6H11ClO/c1-3-5(4-2)6(7)8/h5H,3-4H2,1-2H3
- InChI Key
- SMUKODJVMQOSAB-UHFFFAOYSA-N
- Formula
- C6H11ClO
- SMILES
- CCC(CC)C(=O)Cl
- Molecular Weight1
- 134.60
- CAS
- 2736-40-5
- Other Names
-
- Butanoyl chloride, 2-ethyl-
- Butyryl chloride, 2-ethyl-
- 2-Ethylbutyroyl chloride
- 2-Ethylbutiryl chloride
- Diethylacetyl chloride
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | -143.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -300.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.69 | kJ/mol | Joback Calculated Property |
| log10WS | -2.02 | Crippen Calculated Property | |
| logPoct/wat | 2.188 | Crippen Calculated Property | |
| McVol | 109.210 | ml/mol | McGowan Calculated Property |
| Pc | 3228.31 | kPa | Joback Calculated Property |
| Inp | [850.60; 850.60] |
|
|
| Inp | 850.60 | NIST | |
| Inp | 850.60 | NIST | |
| Tboil | [413.00; 413.00] | K |
|
| Tboil | 413.00 ± 6.00 | K | NIST |
| Tboil | 413.00 ± 6.00 | K | NIST |
| Tc | 616.78 | K | Joback Calculated Property |
| Tfus | 222.23 | K | Joback Calculated Property |
| Vc | 0.420 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [203.25; 257.52] | J/mol×K | [427.54; 616.78] |
|
| Cp,gas | 203.25 | J/mol×K | 427.54 | Joback Calculated Property |
| Cp,gas | 213.38 | J/mol×K | 459.08 | Joback Calculated Property |
| Cp,gas | 223.06 | J/mol×K | 490.62 | Joback Calculated Property |
| Cp,gas | 232.30 | J/mol×K | 522.16 | Joback Calculated Property |
| Cp,gas | 241.12 | J/mol×K | 553.70 | Joback Calculated Property |
| Cp,gas | 249.52 | J/mol×K | 585.24 | Joback Calculated Property |
| Cp,gas | 257.52 | J/mol×K | 616.78 | Joback Calculated Property |
| η | [0.0003354; 0.0059488] | Pa×s | [222.23; 427.54] |
|
| η | 0.0059488 | Pa×s | 222.23 | Joback Calculated Property |
| η | 0.0026756 | Pa×s | 256.45 | Joback Calculated Property |
| η | 0.0014525 | Pa×s | 290.67 | Joback Calculated Property |
| η | 0.0008968 | Pa×s | 324.88 | Joback Calculated Property |
| η | 0.0006070 | Pa×s | 359.10 | Joback Calculated Property |
| η | 0.0004397 | Pa×s | 393.32 | Joback Calculated Property |
| η | 0.0003354 | Pa×s | 427.54 | Joback Calculated Property |
| ΔvapH | 39.40 | kJ/mol | 362.50 | NIST |
Similar Compounds
Find more compounds similar to 2-Ethylbutyryl chloride.
Sources
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