- InChI
- InChI=1S/C8H9Cl/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
- InChI Key
- MNNZINNZIQVULG-UHFFFAOYSA-N
- Formula
- C8H9Cl
- SMILES
- ClCCc1ccccc1
- Molecular Weight1
- 140.61
- CAS
- 622-24-2
- Other Names
-
- (2-Chloroethyl)benzene
- («beta»-Chloroethyl)benzene
- («beta»-Chloroethyl)benzene
- 1-Chloro-2-phenylethane
- 2-Phenyl-1-chloroethane
- 2-Phenylethyl chloride
- NSC 27886
- Phenethyl chloride
- «beta»-Phenethyl chloride
- «beta»-Phenylethyl chloride
- «beta»-Phenethyl chloride
- «beta»-Phenylethyl chloride
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- 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).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔfG° | 116.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 12.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.06 | kJ/mol | Joback Calculated Property |
| log10WS | -2.43 | Crippen Calculated Property | |
| logPoct/wat | 2.468 | Crippen Calculated Property | |
| McVol | 112.060 | ml/mol | McGowan Calculated Property |
| Pc | 3493.01 | kPa | Joback Calculated Property |
| Inp | [167.20; 1090.00] |
|
|
| Inp | 1082.60 | NIST | |
| Inp | 1081.00 | NIST | |
| Inp | 1090.00 | NIST | |
| Inp | 1076.00 | NIST | |
| Inp | 1076.00 | NIST | |
| Inp | 1076.00 | NIST | |
| Inp | Outlier 167.20 | NIST | |
| I | 1593.00 | NIST | |
| Tboil | 446.55 | K | Joback Calculated Property |
| Tc | 663.28 | K | Joback Calculated Property |
| Tfus | 236.26 | K | Joback Calculated Property |
| Vc | 0.424 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [201.71; 264.28] | J/mol×K | [446.55; 663.28] |
|
| Cp,gas | 201.71 | J/mol×K | 446.55 | Joback Calculated Property |
| Cp,gas | 213.93 | J/mol×K | 482.67 | Joback Calculated Property |
| Cp,gas | 225.38 | J/mol×K | 518.79 | Joback Calculated Property |
| Cp,gas | 236.11 | J/mol×K | 554.92 | Joback Calculated Property |
| Cp,gas | 246.15 | J/mol×K | 591.04 | Joback Calculated Property |
| Cp,gas | 255.53 | J/mol×K | 627.16 | Joback Calculated Property |
| Cp,gas | 264.28 | J/mol×K | 663.28 | Joback Calculated Property |
| η | [0.0002678; 0.0033558] | Pa×s | [236.26; 446.55] |
|
| η | 0.0033558 | Pa×s | 236.26 | Joback Calculated Property |
| η | 0.0016772 | Pa×s | 271.31 | Joback Calculated Property |
| η | 0.0009824 | Pa×s | 306.36 | Joback Calculated Property |
| η | 0.0006422 | Pa×s | 341.41 | Joback Calculated Property |
| η | 0.0004544 | Pa×s | 376.45 | Joback Calculated Property |
| η | 0.0003411 | Pa×s | 411.50 | Joback Calculated Property |
| η | 0.0002678 | Pa×s | 446.55 | Joback Calculated Property |
| ΔvapH | [51.70; 53.10] | kJ/mol | [368.00; 418.00] |
|
| ΔvapH | 51.70 | kJ/mol | 368.00 | NIST |
| ΔvapH | 53.10 | kJ/mol | 418.00 | NIST |
| ρl | 1066.91 | kg/m3 | 298.15 | Excess ... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [356.20; 365.20] | K | [2.10; 2.70] |
|
| Tboilr | 356.20 | K | 2.10 | NIST |
| Tboilr | 365.20 | K | 2.70 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [346.52; 490.07] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.49195e+01 | |||
| Coefficient B | -4.01689e+03 | |||
| Coefficient C | -7.19910e+01 | |||
| Temperature range, min. | 346.52 | |||
| Temperature range, max. | 490.07 | |||
| Pvap | 1.33 | kPa | 346.52 | Calculated Property |
| Pvap | 2.98 | kPa | 362.47 | Calculated Property |
| Pvap | 6.12 | kPa | 378.42 | Calculated Property |
| Pvap | 11.70 | kPa | 394.37 | Calculated Property |
| Pvap | 21.05 | kPa | 410.32 | Calculated Property |
| Pvap | 35.92 | kPa | 426.27 | Calculated Property |
| Pvap | 58.54 | kPa | 442.22 | Calculated Property |
| Pvap | 91.64 | kPa | 458.17 | Calculated Property |
| Pvap | 138.44 | kPa | 474.12 | Calculated Property |
| Pvap | 202.66 | kPa | 490.07 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (2-chloroethyl)-.
Mixtures
- Benzene + Benzene, (2-chloroethyl)-
- Toluene + Benzene, (2-chloroethyl)-
- Benzene, (2-chloroethyl)- + Ethylbenzene
- Benzene, (2-chloroethyl)- + Benzene, propyl-
- Benzene, n-butyl- + Benzene, (2-chloroethyl)-
Sources
- Crippen Method
- Crippen Method
- Excess Enthalpies of Chloroalkylbenzene + Alkylbenzene Mixtures
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.