- InChI
- InChI=1S/C11H11ClO2/c12-7-4-8-14-11(13)9-10-5-2-1-3-6-10/h1-7H,8-9H2/b7-4+
- InChI Key
- PBULRLQIJUOCDV-QPJJXVBHSA-N
- Formula
- C11H11ClO2
- SMILES
- O=C(Cc1ccccc1)OCC=CCl
- Molecular Weight1
- 210.66
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -11.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -177.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.86 | kJ/mol | Joback Calculated Property |
| log10WS | -2.89 | Crippen Calculated Property | |
| logPoct/wat | 2.525 | Crippen Calculated Property | |
| McVol | 157.470 | ml/mol | McGowan Calculated Property |
| Pc | 2823.32 | kPa | Joback Calculated Property |
| Inp | 1563.20 | NIST | |
| Tboil | 595.64 | K | Joback Calculated Property |
| Tc | 818.39 | K | Joback Calculated Property |
| Tfus | 337.15 | K | Joback Calculated Property |
| Vc | 0.597 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [353.13; 418.45] | J/mol×K | [595.64; 818.39] | 
|
| Cp,gas | 353.13 | J/mol×K | 595.64 | Joback Calculated Property |
| Cp,gas | 366.08 | J/mol×K | 632.76 | Joback Calculated Property |
| Cp,gas | 378.14 | J/mol×K | 669.89 | Joback Calculated Property |
| Cp,gas | 389.37 | J/mol×K | 707.01 | Joback Calculated Property |
| Cp,gas | 399.80 | J/mol×K | 744.14 | Joback Calculated Property |
| Cp,gas | 409.48 | J/mol×K | 781.26 | Joback Calculated Property |
| Cp,gas | 418.45 | J/mol×K | 818.39 | Joback Calculated Property |
| η | [0.0001667; 0.0019117] | Pa×s | [337.15; 595.64] |
|
| η | 0.0019117 | Pa×s | 337.15 | Joback Calculated Property |
| η | 0.0010111 | Pa×s | 380.23 | Joback Calculated Property |
| η | 0.0006088 | Pa×s | 423.31 | Joback Calculated Property |
| η | 0.0004026 | Pa×s | 466.39 | Joback Calculated Property |
| η | 0.0002855 | Pa×s | 509.48 | Joback Calculated Property |
| η | 0.0002136 | Pa×s | 552.56 | Joback Calculated Property |
| η | 0.0001667 | Pa×s | 595.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenylacetic acid, 3-chloroprop-2-enyl ester.
Sources
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