- InChI
- InChI=1S/C5H9Cl/c1-3-5(6)4-2/h3,5H,1,4H2,2H3
- InChI Key
- GEVKGFRTXNJNKK-UHFFFAOYSA-N
- Formula
- C5H9Cl
- SMILES
- C=CC(Cl)CC
- Molecular Weight1
- 104.58
- CAS
- 24356-00-1
- Other Names
-
- 3-chloro-1-pentene
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Pvap : Vapor 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 | 0.2081 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -90.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 8.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.90 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.190 | Crippen Calculated Property | |
| McVol | 89.250 | ml/mol | McGowan Calculated Property |
| Pc | 3522.09 | kPa | Joback Calculated Property |
| Inp | 688.00 | NIST | |
| Tboil | 364.39 | K | Relay (1.0) Calculated Property |
| Tc | 543.08 | K | Relay (1.0) Calculated Property |
| Tfus | 155.24 | K | Relay (1.0) Calculated Property |
| Vc | 0.330 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [114.83; 257.58] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 6.56100e+00 | |||
| Coefficient B | 4.71520e-01 | |||
| Coefficient C | -2.94700e-04 | |||
| Coefficient D | 7.42000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 114.83 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 139.78 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 161.90 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 181.44 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 198.64 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 213.71 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 226.91 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 238.47 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 248.61 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 257.58 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0062892; 0.0002303] | Pa×s | [159.27; 369.81] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.08780e+01 | |||
| Coefficient B | 9.25220e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 159.27 | |||
| Temperature range, max. | 369.81 | |||
| η | 0.0062892 | Pa×s | 159.27 | Calculated Property |
| η | 0.0029888 | Pa×s | 182.66 | Calculated Property |
| η | 0.0016817 | Pa×s | 206.06 | Calculated Property |
| η | 0.0010640 | Pa×s | 229.45 | Calculated Property |
| η | 0.0007327 | Pa×s | 252.85 | Calculated Property |
| η | 0.0005374 | Pa×s | 276.24 | Calculated Property |
| η | 0.0004138 | Pa×s | 299.63 | Calculated Property |
| η | 0.0003309 | Pa×s | 323.03 | Calculated Property |
| η | 0.0002727 | Pa×s | 346.42 | Calculated Property |
| η | 0.0002303 | Pa×s | 369.81 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.62] | kPa | [270.92; 403.85] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.39273e+01 | |||
| Coefficient B | -3.10959e+03 | |||
| Coefficient C | -4.29400e+01 | |||
| Temperature range, min. | 270.92 | |||
| Temperature range, max. | 403.85 | |||
| Pvap | 1.33 | kPa | 270.92 | Calculated Property |
| Pvap | 3.06 | kPa | 285.69 | Calculated Property |
| Pvap | 6.37 | kPa | 300.46 | Calculated Property |
| Pvap | 12.27 | kPa | 315.23 | Calculated Property |
| Pvap | 22.08 | kPa | 330.00 | Calculated Property |
| Pvap | 37.52 | kPa | 344.77 | Calculated Property |
| Pvap | 60.67 | kPa | 359.54 | Calculated Property |
| Pvap | 94.00 | kPa | 374.31 | Calculated Property |
| Pvap | 140.29 | kPa | 389.08 | Calculated Property |
| Pvap | 202.62 | kPa | 403.85 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Pentene, 3-chloro-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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