- InChI
- InChI=1S/C22H22Cl4O4/c23-15-9-7-10-16(24)21(15)29-19(27)13-5-3-1-2-4-6-14-20(28)30-22-17(25)11-8-12-18(22)26/h7-12H,1-6,13-14H2
- InChI Key
- PPXICGKGQXNXGS-UHFFFAOYSA-N
- Formula
- C22H22Cl4O4
- SMILES
-
O=C(CCCCCCCCC(=O)Oc1c(Cl)cccc1
Cl)Oc1c(Cl)cccc1Cl - Molecular Weight1
- 492.22
- 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° | -194.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -622.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.62 | kJ/mol | Joback Calculated Property |
| log10WS | -9.00 | Crippen Calculated Property | |
| logPoct/wat | 7.932 | Crippen Calculated Property | |
| McVol | 337.160 | ml/mol | McGowan Calculated Property |
| Pc | 1290.21 | kPa | Joback Calculated Property |
| Inp | [3615.00; 3615.00] |
|
|
| Inp | 3615.00 | NIST | |
| Inp | 3615.00 | NIST | |
| Tboil | 1078.34 | K | Joback Calculated Property |
| Tc | 1323.43 | K | Joback Calculated Property |
| Tfus | 704.62 | K | Joback Calculated Property |
| Vc | 1.296 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [973.58; 1004.38] | J/mol×K | [1078.34; 1323.43] |
|
| Cp,gas | 973.58 | J/mol×K | 1078.34 | Joback Calculated Property |
| Cp,gas | 982.06 | J/mol×K | 1119.19 | Joback Calculated Property |
| Cp,gas | 989.14 | J/mol×K | 1160.04 | Joback Calculated Property |
| Cp,gas | 994.87 | J/mol×K | 1200.88 | Joback Calculated Property |
| Cp,gas | 999.29 | J/mol×K | 1241.73 | Joback Calculated Property |
| Cp,gas | 1002.44 | J/mol×K | 1282.58 | Joback Calculated Property |
| Cp,gas | 1004.38 | J/mol×K | 1323.43 | Joback Calculated Property |
| η | [0.0000234; 0.0001418] | Pa×s | [704.62; 1078.34] |
|
| η | 0.0001418 | Pa×s | 704.62 | Joback Calculated Property |
| η | 0.0000930 | Pa×s | 766.91 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 829.19 | Joback Calculated Property |
| η | 0.0000477 | Pa×s | 891.48 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 953.77 | Joback Calculated Property |
| η | 0.0000288 | Pa×s | 1016.05 | Joback Calculated Property |
| η | 0.0000234 | Pa×s | 1078.34 | Joback Calculated Property |
Similar Compounds
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Sources
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