- InChI
- InChI=1S/C9H7Cl3O3/c10-3-4-14-9(13)15-6-1-2-7(11)8(12)5-6/h1-2,5H,3-4H2
- InChI Key
- YLLLCCMOLMFOGA-UHFFFAOYSA-N
- Formula
- C9H7Cl3O3
- SMILES
- O=C(OCCCl)Oc1ccc(Cl)c(Cl)c1
- Molecular Weight1
- 269.51
- 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° | -256.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -439.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.95 | kJ/mol | Joback Calculated Property |
| log10WS | -3.79 | Crippen Calculated Property | |
| logPoct/wat | 3.748 | Crippen Calculated Property | |
| McVol | 163.940 | ml/mol | McGowan Calculated Property |
| Pc | 2881.21 | kPa | Joback Calculated Property |
| Inp | 1852.00 | NIST | |
| Tboil | 652.96 | K | Joback Calculated Property |
| Tc | 880.39 | K | Joback Calculated Property |
| Tfus | 426.80 | K | Joback Calculated Property |
| Vc | 0.621 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [346.70; 394.47] | J/mol×K | [652.96; 880.39] | 
|
| Cp,gas | 346.70 | J/mol×K | 652.96 | Joback Calculated Property |
| Cp,gas | 356.30 | J/mol×K | 690.86 | Joback Calculated Property |
| Cp,gas | 365.25 | J/mol×K | 728.77 | Joback Calculated Property |
| Cp,gas | 373.55 | J/mol×K | 766.67 | Joback Calculated Property |
| Cp,gas | 381.19 | J/mol×K | 804.58 | Joback Calculated Property |
| Cp,gas | 388.17 | J/mol×K | 842.48 | Joback Calculated Property |
| Cp,gas | 394.47 | J/mol×K | 880.39 | Joback Calculated Property |
| η | [0.0001614; 0.0008821] | Pa×s | [426.80; 652.96] |
|
| η | 0.0008821 | Pa×s | 426.80 | Joback Calculated Property |
| η | 0.0005925 | Pa×s | 464.49 | Joback Calculated Property |
| η | 0.0004225 | Pa×s | 502.19 | Joback Calculated Property |
| η | 0.0003158 | Pa×s | 539.88 | Joback Calculated Property |
| η | 0.0002452 | Pa×s | 577.57 | Joback Calculated Property |
| η | 0.0001964 | Pa×s | 615.27 | Joback Calculated Property |
| η | 0.0001614 | Pa×s | 652.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, 2-chloroethyl 3,4-dichlorophenyl ester.
Sources
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