- InChI
- InChI=1S/C8H7Cl/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H2
- InChI Key
- XHAFIUUYXQFJEW-UHFFFAOYSA-N
- Formula
- C8H7Cl
- SMILES
- C=C(Cl)c1ccccc1
- Molecular Weight1
- 138.59
- CAS
- 618-34-8
- Other Names
-
- 1-Chloro-1-phenylethene
- ω : Acentric Factor.
- 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).
- 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).
- 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 | 0.3149 | Relay (1.0) Calculated Property | |
| ΔfG° | 196.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 108.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.64 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.896 | Crippen Calculated Property | |
| McVol | 107.760 | ml/mol | McGowan Calculated Property |
| Pc | 3695.46 | kPa | Joback Calculated Property |
| Tboil | 450.94 | K | Relay (1.0) Calculated Property |
| Tc | 682.14 | K | Relay (1.0) Calculated Property |
| Tfus | 325.00 ± 5.00 | K | NIST |
| Vc | 0.390 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [185.64; 244.06] | J/mol×K | [443.11; 669.55] | 
|
| Cp,gas | 185.64 | J/mol×K | 443.11 | Joback Calculated Property |
| Cp,gas | 197.29 | J/mol×K | 480.85 | Joback Calculated Property |
| Cp,gas | 208.11 | J/mol×K | 518.59 | Joback Calculated Property |
| Cp,gas | 218.16 | J/mol×K | 556.33 | Joback Calculated Property |
| Cp,gas | 227.47 | J/mol×K | 594.07 | Joback Calculated Property |
| Cp,gas | 236.09 | J/mol×K | 631.81 | Joback Calculated Property |
| Cp,gas | 244.06 | J/mol×K | 669.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (1-chloroethenyl)-.
Sources
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