- InChI
- InChI=1S/C8H13ClO/c1-3-5-7(6-10)8(9)4-2/h6H,3-5H2,1-2H3/b8-7-
- InChI Key
- VGVAZOMVBNUYAP-FPLPWBNLSA-N
- Formula
- C8H13ClO
- SMILES
- CCCC(C=O)=C(Cl)CC
- Molecular Weight1
- 160.64
- 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.
- I : 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° | -31.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -212.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.62 | kJ/mol | Joback Calculated Property |
| log10WS | -2.95 | Crippen Calculated Property | |
| logPoct/wat | 2.888 | Crippen Calculated Property | |
| McVol | 133.090 | ml/mol | McGowan Calculated Property |
| Pc | 2808.38 | kPa | Joback Calculated Property |
| Inp | 1004.40 | NIST | |
| I | 1396.40 | NIST | |
| Tboil | 472.45 | K | Joback Calculated Property |
| Tc | 664.80 | K | Joback Calculated Property |
| Tfus | 218.84 | K | Joback Calculated Property |
| Vc | 0.531 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.15; 329.76] | J/mol×K | [472.45; 664.80] | 
|
| Cp,gas | 268.15 | J/mol×K | 472.45 | Joback Calculated Property |
| Cp,gas | 279.86 | J/mol×K | 504.51 | Joback Calculated Property |
| Cp,gas | 290.95 | J/mol×K | 536.57 | Joback Calculated Property |
| Cp,gas | 301.46 | J/mol×K | 568.63 | Joback Calculated Property |
| Cp,gas | 311.41 | J/mol×K | 600.69 | Joback Calculated Property |
| Cp,gas | 320.83 | J/mol×K | 632.74 | Joback Calculated Property |
| Cp,gas | 329.76 | J/mol×K | 664.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to E-3-Chloro-2-propyl-pent-2-enal.
Sources
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