- InChI
- InChI=1S/C8H15ClO3/c1-7(3-4-11-2)6-12-8(10)5-9/h7H,3-6H2,1-2H3
- InChI Key
- IODHLYFOVDUSHK-UHFFFAOYSA-N
- Formula
- C8H15ClO3
- SMILES
- COCCC(C)COC(=O)CCl
- Molecular Weight1
- 194.66
- 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° | -336.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -606.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.97 | kJ/mol | Joback Calculated Property |
| log10WS | -1.03 | Crippen Calculated Property | |
| logPoct/wat | 1.441 | Crippen Calculated Property | |
| McVol | 149.130 | ml/mol | McGowan Calculated Property |
| Pc | 2535.37 | kPa | Joback Calculated Property |
| Inp | [1285.00; 1285.00] |
|
|
| Inp | 1285.00 | NIST | |
| Inp | 1285.00 | NIST | |
| Tboil | 518.14 | K | Joback Calculated Property |
| Tc | 701.81 | K | Joback Calculated Property |
| Tfus | 289.23 | K | Joback Calculated Property |
| Vc | 0.569 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [331.74; 397.07] | J/mol×K | [518.14; 701.81] |
|
| Cp,gas | 331.74 | J/mol×K | 518.14 | Joback Calculated Property |
| Cp,gas | 343.76 | J/mol×K | 548.75 | Joback Calculated Property |
| Cp,gas | 355.33 | J/mol×K | 579.36 | Joback Calculated Property |
| Cp,gas | 366.45 | J/mol×K | 609.97 | Joback Calculated Property |
| Cp,gas | 377.12 | J/mol×K | 640.58 | Joback Calculated Property |
| Cp,gas | 387.32 | J/mol×K | 671.20 | Joback Calculated Property |
| Cp,gas | 397.07 | J/mol×K | 701.81 | Joback Calculated Property |
| η | [0.0002013; 0.0029751] | Pa×s | [289.23; 518.14] |
|
| η | 0.0029751 | Pa×s | 289.23 | Joback Calculated Property |
| η | 0.0014621 | Pa×s | 327.38 | Joback Calculated Property |
| η | 0.0008334 | Pa×s | 365.53 | Joback Calculated Property |
| η | 0.0005283 | Pa×s | 403.69 | Joback Calculated Property |
| η | 0.0003623 | Pa×s | 441.84 | Joback Calculated Property |
| η | 0.0002638 | Pa×s | 479.99 | Joback Calculated Property |
| η | 0.0002013 | Pa×s | 518.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Chloroacetic acid, 4-methoxy-2-methylbutyl ester.
Sources
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