- InChI
- InChI=1S/C4H7Cl/c1-2-3-4-5/h2-3H,4H2,1H3
- InChI Key
- YTKRILODNOEEPX-UHFFFAOYSA-N
- Formula
- C4H7Cl
- SMILES
- CC=CCCl
- Molecular Weight1
- 90.55
- CAS
- 591-97-9
- Other Names
-
- 1-Chloro-2-butene
- 1-chlorobut-2-ene
- 2-Butenyl chloride
- Crotyl chloride
- «alpha»-Chloro-«beta»-butylene
- «gamma»-Methallyl chloride
- «gamma»-Methylallyl chloride
- «alpha»-Chloro-«beta»-butylene
- «gamma»-Methallyl chloride
- «gamma»-Methylallyl chloride
- 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).
- 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).
- Pvap : Vapor pressure (kPa).
- 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 | 0.2129 | Relay (1.0) Calculated Property | |
| ΔfG° | 51.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -49.37 | kJ/mol | NIST |
| ΔfusH° | 10.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 33.41 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.46 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.801 | Crippen Calculated Property | |
| McVol | 75.160 | ml/mol | McGowan Calculated Property |
| Pc | 3970.51 | kPa | Joback Calculated Property |
| Tboil | [356.15; 357.40] | K |
|
| Tboil | 357.40 ± 1.00 | K | NIST |
| Tboil | 357.15 ± 2.00 | K | NIST |
| Tboil | 357.15 ± 2.00 | K | NIST |
| Tboil | 357.15 ± 2.00 | K | NIST |
| Tboil | 356.15 ± 2.00 | K | NIST |
| Tc | 536.69 | K | Relay (1.0) Calculated Property |
| Tfus | 182.23 | K | Relay (1.0) Calculated Property |
| Vc | 0.264 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [104.96; 143.01] | J/mol×K | [332.51; 514.66] |
|
| Cp,gas | 104.96 | J/mol×K | 332.51 | Joback Calculated Property |
| Cp,gas | 112.16 | J/mol×K | 362.87 | Joback Calculated Property |
| Cp,gas | 118.99 | J/mol×K | 393.23 | Joback Calculated Property |
| Cp,gas | 125.48 | J/mol×K | 423.59 | Joback Calculated Property |
| Cp,gas | 131.63 | J/mol×K | 453.95 | Joback Calculated Property |
| Cp,gas | 137.47 | J/mol×K | 484.30 | Joback Calculated Property |
| Cp,gas | 143.01 | J/mol×K | 514.66 | Joback Calculated Property |
| η | [0.0002244; 0.0033962] | Pa×s | [159.68; 332.51] |
|
| η | 0.0033962 | Pa×s | 159.68 | Joback Calculated Property |
| η | 0.0015278 | Pa×s | 188.49 | Joback Calculated Property |
| η | 0.0008494 | Pa×s | 217.29 | Joback Calculated Property |
| η | 0.0005418 | Pa×s | 246.09 | Joback Calculated Property |
| η | 0.0003798 | Pa×s | 274.90 | Joback Calculated Property |
| η | 0.0002848 | Pa×s | 303.70 | Joback Calculated Property |
| η | 0.0002244 | Pa×s | 332.51 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [262.72; 380.54] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.48493e+01 | |||
| Coefficient B | -3.25704e+03 | |||
| Coefficient C | -3.90480e+01 | |||
| Temperature range, min. | 262.72 | |||
| Temperature range, max. | 380.54 | |||
| Pvap | 1.33 | kPa | 262.72 | Calculated Property |
| Pvap | 2.98 | kPa | 275.81 | Calculated Property |
| Pvap | 6.13 | kPa | 288.90 | Calculated Property |
| Pvap | 11.73 | kPa | 301.99 | Calculated Property |
| Pvap | 21.11 | kPa | 315.08 | Calculated Property |
| Pvap | 36.02 | kPa | 328.18 | Calculated Property |
| Pvap | 58.68 | kPa | 341.27 | Calculated Property |
| Pvap | 91.80 | kPa | 354.36 | Calculated Property |
| Pvap | 138.57 | kPa | 367.45 | Calculated Property |
| Pvap | 202.67 | kPa | 380.54 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Butene, 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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