- InChI
- InChI=1S/C9H5Cl5O3/c10-6-2-1-5(3-7(6)11)17-8(15)16-4-9(12,13)14/h1-3H,4H2
- InChI Key
- ZLYNSNLAIUXXFY-UHFFFAOYSA-N
- Formula
- C9H5Cl5O3
- SMILES
-
O=C(OCC(Cl)(Cl)Cl)Oc1ccc(Cl)c(
Cl)c1 - Molecular Weight1
- 338.40
- 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° | -277.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -479.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.42 | kJ/mol | Joback Calculated Property |
| log10WS | -5.20 | Crippen Calculated Property | |
| logPoct/wat | 4.879 | Crippen Calculated Property | |
| McVol | 188.420 | ml/mol | McGowan Calculated Property |
| Pc | 2718.33 | kPa | Joback Calculated Property |
| Inp | 2006.00 | NIST | |
| Tboil | 724.59 | K | Joback Calculated Property |
| Tc | 970.75 | K | Joback Calculated Property |
| Tfus | 489.06 | K | Joback Calculated Property |
| Vc | 0.708 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [389.19; 425.27] | J/mol×K | [724.59; 970.75] | 
|
| Cp,gas | 389.19 | J/mol×K | 724.59 | Joback Calculated Property |
| Cp,gas | 397.09 | J/mol×K | 765.62 | Joback Calculated Property |
| Cp,gas | 404.19 | J/mol×K | 806.64 | Joback Calculated Property |
| Cp,gas | 410.54 | J/mol×K | 847.67 | Joback Calculated Property |
| Cp,gas | 416.14 | J/mol×K | 888.70 | Joback Calculated Property |
| Cp,gas | 421.04 | J/mol×K | 929.72 | Joback Calculated Property |
| Cp,gas | 425.27 | J/mol×K | 970.75 | Joback Calculated Property |
| η | [0.0001075; 0.0006365] | Pa×s | [489.06; 724.59] |
|
| η | 0.0006365 | Pa×s | 489.06 | Joback Calculated Property |
| η | 0.0004239 | Pa×s | 528.32 | Joback Calculated Property |
| η | 0.0002986 | Pa×s | 567.57 | Joback Calculated Property |
| η | 0.0002201 | Pa×s | 606.83 | Joback Calculated Property |
| η | 0.0001684 | Pa×s | 646.08 | Joback Calculated Property |
| η | 0.0001328 | Pa×s | 685.34 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 724.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, 2,2,2-trichloroethyl 3,4-dichlorophenyl ester.
Sources
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