- InChI
- InChI=1S/C9H7Cl3/c1-7(9(10,11)12)8-5-3-2-4-6-8/h2-6H,1H2
- InChI Key
- JFRUTHVQVYNYAW-UHFFFAOYSA-N
- Formula
- C9H7Cl3
- SMILES
- C=C(c1ccccc1)C(Cl)(Cl)Cl
- Molecular Weight1
- 221.51
- 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).
- 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 | 0.2950 | Relay (1.0) Calculated Property | |
| ΔfG° | 183.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 76.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.070 | Crippen Calculated Property | |
| McVol | 146.330 | ml/mol | McGowan Calculated Property |
| Pc | 3100.18 | kPa | Joback Calculated Property |
| Inp | 1181.00 | NIST | |
| Tboil | 528.18 | K | Relay (1.0) Calculated Property |
| Tc | 737.21 | K | Relay (1.0) Calculated Property |
| Tfus | 287.35 | K | Relay (1.0) Calculated Property |
| Vc | 0.509 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [278.34; 334.39] | J/mol×K | [537.62; 787.32] | 
|
| Cp,gas | 278.34 | J/mol×K | 537.62 | Joback Calculated Property |
| Cp,gas | 290.27 | J/mol×K | 579.24 | Joback Calculated Property |
| Cp,gas | 301.03 | J/mol×K | 620.85 | Joback Calculated Property |
| Cp,gas | 310.72 | J/mol×K | 662.47 | Joback Calculated Property |
| Cp,gas | 319.44 | J/mol×K | 704.09 | Joback Calculated Property |
| Cp,gas | 327.29 | J/mol×K | 745.70 | Joback Calculated Property |
| Cp,gas | 334.39 | J/mol×K | 787.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Styrene, «alpha»-(chloromethyl).
Sources
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