- InChI
- InChI=1S/C23H31Cl5O4/c1-4-5-6-7-8-9-10-11-12-13-14-31-21(29)23(2,3)22(30)32-20-18(27)16(25)15(24)17(26)19(20)28/h4-14H2,1-3H3
- InChI Key
- OIXATLVZKLVBLC-UHFFFAOYSA-N
- Formula
- C23H31Cl5O4
- SMILES
-
CCCCCCCCCCCCOC(=O)C(C)(C)C(=O)
Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl - Molecular Weight1
- 548.75
- 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° | -317.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -915.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.32 | kJ/mol | Joback Calculated Property |
| log10WS | -10.11 | Crippen Calculated Property | |
| logPoct/wat | 9.349 | Crippen Calculated Property | |
| McVol | 387.250 | ml/mol | McGowan Calculated Property |
| Pc | 950.25 | kPa | Joback Calculated Property |
| Inp | [3444.00; 3444.00] |
|
|
| Inp | 3444.00 | NIST | |
| Inp | 3444.00 | NIST | |
| Tboil | 1113.72 | K | Joback Calculated Property |
| Tc | 1364.34 | K | Joback Calculated Property |
| Tfus | 734.33 | K | Joback Calculated Property |
| Vc | 1.498 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1166.42; 1209.46] | J/mol×K | [1113.72; 1364.34] |
|
| Cp,gas | 1166.42 | J/mol×K | 1113.72 | Joback Calculated Property |
| Cp,gas | 1176.94 | J/mol×K | 1155.49 | Joback Calculated Property |
| Cp,gas | 1186.02 | J/mol×K | 1197.26 | Joback Calculated Property |
| Cp,gas | 1193.75 | J/mol×K | 1239.03 | Joback Calculated Property |
| Cp,gas | 1200.19 | J/mol×K | 1280.80 | Joback Calculated Property |
| Cp,gas | 1205.40 | J/mol×K | 1322.57 | Joback Calculated Property |
| Cp,gas | 1209.46 | J/mol×K | 1364.34 | Joback Calculated Property |
| η | [0.0000120; 0.0000797] | Pa×s | [734.33; 1113.72] |
|
| η | 0.0000797 | Pa×s | 734.33 | Joback Calculated Property |
| η | 0.0000512 | Pa×s | 797.56 | Joback Calculated Property |
| η | 0.0000352 | Pa×s | 860.79 | Joback Calculated Property |
| η | 0.0000254 | Pa×s | 924.02 | Joback Calculated Property |
| η | 0.0000191 | Pa×s | 987.26 | Joback Calculated Property |
| η | 0.0000149 | Pa×s | 1050.49 | Joback Calculated Property |
| η | 0.0000120 | Pa×s | 1113.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, dodecyl pentachlorophenyl ester.
Sources
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