- InChI
- InChI=1S/C5H9Cl/c1-3-4-5(2)6/h3-5H,1-2H3/b4-3+
- InChI Key
- FKKCIOTUMHPTSB-ONEGZZNKSA-N
- Formula
- C5H9Cl
- SMILES
- CC=CC(C)Cl
- Molecular Weight1
- 104.58
- CAS
- 1458-99-7
- 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).
- 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 | 0.2294 | Relay (1.0) Calculated Property | |
| ΔfG° | 57.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -105.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.53 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.190 | Crippen Calculated Property | |
| McVol | 89.250 | ml/mol | McGowan Calculated Property |
| Pc | 3564.27 | kPa | Joback Calculated Property |
| Inp | 742.00 | NIST | |
| Tboil | 371.13 | K | Relay (1.0) Calculated Property |
| Tc | 543.60 | K | Relay (1.0) Calculated Property |
| Tfus | 174.05 | K | Relay (1.0) Calculated Property |
| Vc | 0.327 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [136.86; 184.71] | J/mol×K | [355.15; 541.78] | 
|
| Cp,gas | 136.86 | J/mol×K | 355.15 | Joback Calculated Property |
| Cp,gas | 145.91 | J/mol×K | 386.26 | Joback Calculated Property |
| Cp,gas | 154.50 | J/mol×K | 417.36 | Joback Calculated Property |
| Cp,gas | 162.66 | J/mol×K | 448.47 | Joback Calculated Property |
| Cp,gas | 170.40 | J/mol×K | 479.57 | Joback Calculated Property |
| Cp,gas | 177.74 | J/mol×K | 510.68 | Joback Calculated Property |
| Cp,gas | 184.71 | J/mol×K | 541.78 | Joback Calculated Property |
| η | [0.0002296; 0.0074259] | Pa×s | [155.95; 355.15] |
|
| η | 0.0074259 | Pa×s | 155.95 | Joback Calculated Property |
| η | 0.0025019 | Pa×s | 189.15 | Joback Calculated Property |
| η | 0.0011665 | Pa×s | 222.35 | Joback Calculated Property |
| η | 0.0006631 | Pa×s | 255.55 | Joback Calculated Property |
| η | 0.0004293 | Pa×s | 288.75 | Joback Calculated Property |
| η | 0.0003039 | Pa×s | 321.95 | Joback Calculated Property |
| η | 0.0002296 | Pa×s | 355.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Pentene, 4-chloro-.
Sources
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