- InChI
- InChI=1S/C9H9ClO2/c10-5-6-12-9-3-1-8(7-11)2-4-9/h1-4,7H,5-6H2
- InChI Key
- HBHHMVNKQWECIS-UHFFFAOYSA-N
- Formula
- C9H9ClO2
- SMILES
- O=Cc1ccc(OCCCl)cc1
- Molecular Weight1
- 184.62
- CAS
- 54373-15-8
- 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).
- 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° | -88.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -237.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.08 | kJ/mol | Joback Calculated Property |
| log10WS | -2.40 | Crippen Calculated Property | |
| logPoct/wat | 2.117 | Crippen Calculated Property | |
| McVol | 133.590 | ml/mol | McGowan Calculated Property |
| Pc | 3280.28 | kPa | Joback Calculated Property |
| Tboil | 545.49 | K | Joback Calculated Property |
| Tc | 762.26 | K | Joback Calculated Property |
| Tfus | 324.28 | K | Joback Calculated Property |
| Vc | 0.515 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [282.18; 340.01] | J/mol×K | [545.49; 762.26] | 
|
| Cp,gas | 282.18 | J/mol×K | 545.49 | Joback Calculated Property |
| Cp,gas | 293.39 | J/mol×K | 581.62 | Joback Calculated Property |
| Cp,gas | 303.95 | J/mol×K | 617.75 | Joback Calculated Property |
| Cp,gas | 313.88 | J/mol×K | 653.88 | Joback Calculated Property |
| Cp,gas | 323.19 | J/mol×K | 690.01 | Joback Calculated Property |
| Cp,gas | 331.89 | J/mol×K | 726.13 | Joback Calculated Property |
| Cp,gas | 340.01 | J/mol×K | 762.26 | Joback Calculated Property |
| η | [0.0002491; 0.0019031] | Pa×s | [324.28; 545.49] |
|
| η | 0.0019031 | Pa×s | 324.28 | Joback Calculated Property |
| η | 0.0011406 | Pa×s | 361.15 | Joback Calculated Property |
| η | 0.0007517 | Pa×s | 398.02 | Joback Calculated Property |
| η | 0.0005316 | Pa×s | 434.88 | Joback Calculated Property |
| η | 0.0003969 | Pa×s | 471.75 | Joback Calculated Property |
| η | 0.0003092 | Pa×s | 508.62 | Joback Calculated Property |
| η | 0.0002491 | Pa×s | 545.49 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 419.00 ± 1.00 | K | 0.30 | NIST |
Similar Compounds
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Sources
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