- InChI
- InChI=1S/C9H9ClO3/c1-12-9-4-8(10)3-2-7(9)5-13-6-11/h2-4,6H,5H2,1H3
- InChI Key
- KZQCTTJBDTWLDC-UHFFFAOYSA-N
- Formula
- C9H9ClO3
- SMILES
- COc1cc(Cl)ccc1COC=O
- Molecular Weight1
- 200.62
- 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° | -203.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -381.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.15 | kJ/mol | Joback Calculated Property |
| log10WS | -2.44 | Crippen Calculated Property | |
| logPoct/wat | 2.022 | Crippen Calculated Property | |
| McVol | 139.460 | ml/mol | McGowan Calculated Property |
| Pc | 3163.27 | kPa | Joback Calculated Property |
| Inp | [1513.00; 1513.00] |
|
|
| Inp | 1513.00 | NIST | |
| Inp | 1513.00 | NIST | |
| Tboil | 572.89 | K | Joback Calculated Property |
| Tc | 788.23 | K | Joback Calculated Property |
| Tfus | 359.03 | K | Joback Calculated Property |
| Vc | 0.533 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [303.70; 360.16] | J/mol×K | [572.89; 788.23] |
|
| Cp,gas | 303.70 | J/mol×K | 572.89 | Joback Calculated Property |
| Cp,gas | 314.50 | J/mol×K | 608.78 | Joback Calculated Property |
| Cp,gas | 324.76 | J/mol×K | 644.67 | Joback Calculated Property |
| Cp,gas | 334.46 | J/mol×K | 680.56 | Joback Calculated Property |
| Cp,gas | 343.60 | J/mol×K | 716.45 | Joback Calculated Property |
| Cp,gas | 352.17 | J/mol×K | 752.34 | Joback Calculated Property |
| Cp,gas | 360.16 | J/mol×K | 788.23 | Joback Calculated Property |
| η | [0.0001983; 0.0011578] | Pa×s | [359.03; 572.89] |
|
| η | 0.0011578 | Pa×s | 359.03 | Joback Calculated Property |
| η | 0.0007556 | Pa×s | 394.67 | Joback Calculated Property |
| η | 0.0005292 | Pa×s | 430.32 | Joback Calculated Property |
| η | 0.0003914 | Pa×s | 465.96 | Joback Calculated Property |
| η | 0.0003021 | Pa×s | 501.60 | Joback Calculated Property |
| η | 0.0002414 | Pa×s | 537.25 | Joback Calculated Property |
| η | 0.0001983 | Pa×s | 572.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Formic acid, (4-chloro-2-methoxyphenyl)methyl ester.
Sources
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