- InChI
- InChI=1S/C7H11ClO2/c1-3-6(2)7(9)10-5-4-8/h3H,4-5H2,1-2H3/b6-3+
- InChI Key
- UTHIRZUMGCPHPR-ZZXKWVIFSA-N
- Formula
- C7H11ClO2
- SMILES
- CC=C(C)C(=O)OCCCl
- Molecular Weight1
- 162.61
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -166.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -340.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.75 | kJ/mol | Joback Calculated Property |
| log10WS | -1.62 | Crippen Calculated Property | |
| logPoct/wat | 1.735 | Crippen Calculated Property | |
| McVol | 124.870 | ml/mol | McGowan Calculated Property |
| Pc | 3005.73 | kPa | Joback Calculated Property |
| Inp | [1159.00; 1159.00] |
|
|
| Inp | 1159.00 | NIST | |
| Inp | 1159.00 | NIST | |
| Tboil | 477.32 | K | Joback Calculated Property |
| Tc | 672.15 | K | Joback Calculated Property |
| Tfus | 251.69 | K | Joback Calculated Property |
| Vc | 0.481 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [248.04; 303.98] | J/mol×K | [477.32; 672.15] |
|
| Cp,gas | 248.04 | J/mol×K | 477.32 | Joback Calculated Property |
| Cp,gas | 258.54 | J/mol×K | 509.79 | Joback Calculated Property |
| Cp,gas | 268.56 | J/mol×K | 542.26 | Joback Calculated Property |
| Cp,gas | 278.09 | J/mol×K | 574.74 | Joback Calculated Property |
| Cp,gas | 287.17 | J/mol×K | 607.21 | Joback Calculated Property |
| Cp,gas | 295.79 | J/mol×K | 639.68 | Joback Calculated Property |
| Cp,gas | 303.98 | J/mol×K | 672.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chloroethyl (E)-2-methylbut-2-enoate.
Sources
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