- InChI
- InChI=1S/C25H39ClO4/c1-5-8-9-10-11-12-13-14-15-18-29-23(27)25(6-2,7-3)24(28)30-21-16-17-22(26)20(4)19-21/h16-17,19H,5-15,18H2,1-4H3
- InChI Key
- PEOGCBIPLSUMDX-UHFFFAOYSA-N
- Formula
- C25H39ClO4
- SMILES
-
CCCCCCCCCCCOC(=O)C(CC)(CC)C(=O
)Oc1ccc(Cl)c(C)c1 - Molecular Weight1
- 439.03
- 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° | -224.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -859.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.24 | kJ/mol | Joback Calculated Property |
| log10WS | -8.26 | Crippen Calculated Property | |
| logPoct/wat | 7.434 | Crippen Calculated Property | |
| McVol | 366.470 | ml/mol | McGowan Calculated Property |
| Pc | 950.84 | kPa | Joback Calculated Property |
| Inp | [2827.00; 2827.00] |
|
|
| Inp | 2827.00 | NIST | |
| Inp | 2827.00 | NIST | |
| Tboil | 994.82 | K | Joback Calculated Property |
| Tc | 1217.98 | K | Joback Calculated Property |
| Tfus | 599.63 | K | Joback Calculated Property |
| Vc | 1.413 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1206.95; 1283.68] | J/mol×K | [994.82; 1217.98] |
|
| Cp,gas | 1206.95 | J/mol×K | 994.82 | Joback Calculated Property |
| Cp,gas | 1222.98 | J/mol×K | 1032.01 | Joback Calculated Property |
| Cp,gas | 1237.62 | J/mol×K | 1069.21 | Joback Calculated Property |
| Cp,gas | 1250.94 | J/mol×K | 1106.40 | Joback Calculated Property |
| Cp,gas | 1263.02 | J/mol×K | 1143.59 | Joback Calculated Property |
| Cp,gas | 1273.91 | J/mol×K | 1180.78 | Joback Calculated Property |
| Cp,gas | 1283.68 | J/mol×K | 1217.98 | Joback Calculated Property |
| η | [0.0000173; 0.0002061] | Pa×s | [599.63; 994.82] |
|
| η | 0.0002061 | Pa×s | 599.63 | Joback Calculated Property |
| η | 0.0001111 | Pa×s | 665.50 | Joback Calculated Property |
| η | 0.0000670 | Pa×s | 731.36 | Joback Calculated Property |
| η | 0.0000439 | Pa×s | 797.23 | Joback Calculated Property |
| η | 0.0000307 | Pa×s | 863.09 | Joback Calculated Property |
| η | 0.0000225 | Pa×s | 928.95 | Joback Calculated Property |
| η | 0.0000173 | Pa×s | 994.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 4-chloro-3-methylphenyl undecyl ester.
Sources
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