- InChI
- InChI=1S/C8H4Cl4O2/c1-3(13)14-8-6(11)4(9)2-5(10)7(8)12/h2H,1H3
- InChI Key
- NHBOZDKIYJWIIT-UHFFFAOYSA-N
- Formula
- C8H4Cl4O2
- SMILES
- CC(=O)Oc1c(Cl)c(Cl)cc(Cl)c1Cl
- Molecular Weight1
- 273.93
- CAS
- 61925-90-4
- Other Names
-
- Acetic acid, 2,3,5,6-tetrachlorophenyl ester
- ]Henol, 2,3,5,6-tetrachloro-, acetate
- 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.
- I : 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° | -191.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -325.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.02 | kJ/mol | Joback Calculated Property |
| log10WS | -4.53 | Crippen Calculated Property | |
| logPoct/wat | 4.226 | Crippen Calculated Property | |
| McVol | 156.220 | ml/mol | McGowan Calculated Property |
| Pc | 3028.94 | kPa | Joback Calculated Property |
| Inp | [1612.00; 1633.00] |
|
|
| Inp | 1612.00 | NIST | |
| Inp | 1612.00 | NIST | |
| Inp | 1633.00 | NIST | |
| I | 2225.00 | NIST | |
| Tboil | 655.05 | K | Joback Calculated Property |
| Tc | 895.37 | K | Joback Calculated Property |
| Tfus | 448.26 | K | Joback Calculated Property |
| Vc | 0.596 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [294.91; 332.02] | J/mol×K | [655.05; 895.37] |
|
| Cp,gas | 294.91 | J/mol×K | 655.05 | Joback Calculated Property |
| Cp,gas | 302.43 | J/mol×K | 695.10 | Joback Calculated Property |
| Cp,gas | 309.43 | J/mol×K | 735.16 | Joback Calculated Property |
| Cp,gas | 315.89 | J/mol×K | 775.21 | Joback Calculated Property |
| Cp,gas | 321.82 | J/mol×K | 815.26 | Joback Calculated Property |
| Cp,gas | 327.20 | J/mol×K | 855.31 | Joback Calculated Property |
| Cp,gas | 332.02 | J/mol×K | 895.37 | Joback Calculated Property |
| η | [0.0002093; 0.0008237] | Pa×s | [448.26; 655.05] |
|
| η | 0.0008237 | Pa×s | 448.26 | Joback Calculated Property |
| η | 0.0006042 | Pa×s | 482.72 | Joback Calculated Property |
| η | 0.0004619 | Pa×s | 517.19 | Joback Calculated Property |
| η | 0.0003652 | Pa×s | 551.65 | Joback Calculated Property |
| η | 0.0002968 | Pa×s | 586.12 | Joback Calculated Property |
| η | 0.0002468 | Pa×s | 620.59 | Joback Calculated Property |
| η | 0.0002093 | Pa×s | 655.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 2,3,5,6-tetrachloro-, acetate.
Sources
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