- InChI
- InChI=1S/C5H9Cl/c1-2-3-4-5-6/h4-5H,2-3H2,1H3
- InChI Key
- NKNYZKFBNQUWTM-SNAWJCMRSA-N
- Formula
- C5H9Cl
- SMILES
- CCC/C=C/Cl
- Molecular Weight1
- 104.58
- CAS
- 21450-13-5
- Other Names
-
- 1-chloro-1-pentene
- 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).
- 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 | 0.2441 | Relay (1.0) Calculated Property | |
| ΔfG° | 59.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -44.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 33.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.44 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.539 | Crippen Calculated Property | |
| McVol | 89.250 | ml/mol | McGowan Calculated Property |
| Pc | 3530.46 | kPa | Joback Calculated Property |
| Inp | [730.00; 730.00] |
|
|
| Inp | 730.00 | NIST | |
| Inp | 730.00 | NIST | |
| Tboil | 369.53 | K | Relay (1.0) Calculated Property |
| Tc | 540.51 | K | Relay (1.0) Calculated Property |
| Tfus | 152.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.334 | 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [110.95; 254.97] | 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 | -2.94800e+00 | |||
| Coefficient B | 5.05620e-01 | |||
| Coefficient C | -3.52400e-04 | |||
| Coefficient D | 1.04700e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 110.95 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 136.46 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 158.82 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 178.36 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 195.41 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 210.31 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 223.38 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 234.96 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 245.38 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 254.97 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0039506; 0.0002036] | Pa×s | [170.95; 376.38] |
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 | -1.09670e+01 | |||
| Coefficient B | 9.28800e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 170.95 | |||
| Temperature range, max. | 376.38 | |||
| η | 0.0039506 | Pa×s | 170.95 | Calculated Property |
| η | 0.0020831 | Pa×s | 193.78 | Calculated Property |
| η | 0.0012571 | Pa×s | 216.60 | Calculated Property |
| η | 0.0008352 | Pa×s | 239.43 | Calculated Property |
| η | 0.0005959 | Pa×s | 262.25 | Calculated Property |
| η | 0.0004488 | Pa×s | 285.08 | Calculated Property |
| η | 0.0003525 | Pa×s | 307.90 | Calculated Property |
| η | 0.0002862 | Pa×s | 330.73 | Calculated Property |
| η | 0.0002388 | Pa×s | 353.55 | Calculated Property |
| η | 0.0002036 | Pa×s | 376.38 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [270.84; 403.89] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.39182e+01 | |||
| Coefficient B | -3.10679e+03 | |||
| Coefficient C | -4.29120e+01 | |||
| Temperature range, min. | 270.84 | |||
| Temperature range, max. | 403.89 | |||
| Pvap | 1.33 | kPa | 270.84 | Calculated Property |
| Pvap | 3.06 | kPa | 285.62 | Calculated Property |
| Pvap | 6.38 | kPa | 300.41 | Calculated Property |
| Pvap | 12.28 | kPa | 315.19 | Calculated Property |
| Pvap | 22.10 | kPa | 329.97 | Calculated Property |
| Pvap | 37.54 | kPa | 344.76 | Calculated Property |
| Pvap | 60.71 | kPa | 359.54 | Calculated Property |
| Pvap | 94.04 | kPa | 374.32 | Calculated Property |
| Pvap | 140.34 | kPa | 389.11 | Calculated Property |
| Pvap | 202.67 | kPa | 403.89 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Pentene, 1-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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