- InChI
- InChI=1S/C9H11ClO2/c1-11-9(12-2)7-3-5-8(10)6-4-7/h3-6,9H,1-2H3
- InChI Key
- YRNBYTFFWMWTGG-UHFFFAOYSA-N
- Formula
- C9H11ClO2
- SMILES
- COC(OC)c1ccc(Cl)cc1
- Molecular Weight1
- 186.63
- CAS
- 3395-81-1
- 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).
- 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° | -96.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -289.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.38 | kJ/mol | Joback Calculated Property |
| log10WS | -2.51 | Crippen Calculated Property | |
| logPoct/wat | 2.631 | Crippen Calculated Property | |
| McVol | 137.890 | ml/mol | McGowan Calculated Property |
| Pc | 2989.32 | kPa | Joback Calculated Property |
| Tboil | 518.81 | K | Joback Calculated Property |
| Tc | 734.53 | K | Joback Calculated Property |
| Tfus | 289.51 | K | Joback Calculated Property |
| Vc | 0.510 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [289.12; 356.22] | J/mol×K | [518.81; 734.53] | 
|
| Cp,gas | 289.12 | J/mol×K | 518.81 | Joback Calculated Property |
| Cp,gas | 301.86 | J/mol×K | 554.76 | Joback Calculated Property |
| Cp,gas | 313.97 | J/mol×K | 590.72 | Joback Calculated Property |
| Cp,gas | 325.47 | J/mol×K | 626.67 | Joback Calculated Property |
| Cp,gas | 336.34 | J/mol×K | 662.62 | Joback Calculated Property |
| Cp,gas | 346.59 | J/mol×K | 698.58 | Joback Calculated Property |
| Cp,gas | 356.22 | J/mol×K | 734.53 | Joback Calculated Property |
| η | [0.0001629; 0.0018544] | Pa×s | [289.51; 518.81] |
|
| η | 0.0018544 | Pa×s | 289.51 | Joback Calculated Property |
| η | 0.0009761 | Pa×s | 327.73 | Joback Calculated Property |
| η | 0.0005875 | Pa×s | 365.94 | Joback Calculated Property |
| η | 0.0003892 | Pa×s | 404.16 | Joback Calculated Property |
| η | 0.0002769 | Pa×s | 442.38 | Joback Calculated Property |
| η | 0.0002079 | Pa×s | 480.59 | Joback Calculated Property |
| η | 0.0001629 | Pa×s | 518.81 | Joback Calculated Property |
Similar Compounds
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Sources
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