- InChI
- InChI=1S/C23H36O5/c1-5-8-9-10-11-12-13-17-27-21(24)23(6-2,7-3)22(25)28-20-16-14-15-19(18-20)26-4/h14-16,18H,5-13,17H2,1-4H3
- InChI Key
- ABJUXKSMMRGBAJ-UHFFFAOYSA-N
- Formula
- C23H36O5
- SMILES
-
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)O
c1cccc(OC)c1 - Molecular Weight1
- 392.53
- 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° | -324.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -923.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.16 | kJ/mol | Joback Calculated Property |
| log10WS | -6.39 | Crippen Calculated Property | |
| logPoct/wat | 5.701 | Crippen Calculated Property | |
| McVol | 331.920 | ml/mol | McGowan Calculated Property |
| Pc | 1099.35 | kPa | Joback Calculated Property |
| Inp | [2598.00; 2598.00] |
|
|
| Inp | 2598.00 | NIST | |
| Inp | 2598.00 | NIST | |
| Tboil | 929.07 | K | Joback Calculated Property |
| Tc | 1139.98 | K | Joback Calculated Property |
| Tfus | 556.88 | K | Joback Calculated Property |
| Vc | 1.270 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1088.08; 1165.60] | J/mol×K | [929.07; 1139.98] |
|
| Cp,gas | 1088.08 | J/mol×K | 929.07 | Joback Calculated Property |
| Cp,gas | 1104.27 | J/mol×K | 964.22 | Joback Calculated Property |
| Cp,gas | 1119.11 | J/mol×K | 999.37 | Joback Calculated Property |
| Cp,gas | 1132.62 | J/mol×K | 1034.52 | Joback Calculated Property |
| Cp,gas | 1144.84 | J/mol×K | 1069.67 | Joback Calculated Property |
| Cp,gas | 1155.83 | J/mol×K | 1104.82 | Joback Calculated Property |
| Cp,gas | 1165.60 | J/mol×K | 1139.98 | Joback Calculated Property |
| η | [0.0000204; 0.0002633] | Pa×s | [556.88; 929.07] |
|
| η | 0.0002633 | Pa×s | 556.88 | Joback Calculated Property |
| η | 0.0001388 | Pa×s | 618.91 | Joback Calculated Property |
| η | 0.0000822 | Pa×s | 680.94 | Joback Calculated Property |
| η | 0.0000532 | Pa×s | 742.98 | Joback Calculated Property |
| η | 0.0000368 | Pa×s | 805.01 | Joback Calculated Property |
| η | 0.0000268 | Pa×s | 867.04 | Joback Calculated Property |
| η | 0.0000204 | Pa×s | 929.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 3-methoxyphenyl nonyl ester.
Sources
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