- InChI
- InChI=1S/C20H36O5/c1-4-7-8-9-10-11-14-24-18(21)20(5-2,6-3)19(22)25-16-17-13-12-15-23-17/h17H,4-16H2,1-3H3
- InChI Key
- DYJPLVPIGIBPIZ-UHFFFAOYSA-N
- Formula
- C20H36O5
- SMILES
-
CCCCCCCCOC(=O)C(CC)(CC)C(=O)OC
C1CCCO1 - Molecular Weight1
- 356.50
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8903 | Relay (... Calculated Property | |
| ΔfG° | -397.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1120.37 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 47.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.95 | kJ/mol | Relay (... Calculated Property |
| IE | 9.41 | eV | Relay (... Calculated Property |
| log10WS | -3.92 | Relay (... Calculated Property | |
| logPoct/wat | 4.419 | Crippen Calculated Property | |
| McVol | 302.550 | ml/mol | McGowan Calculated Property |
| Pc | 1225.98 | kPa | Joback Calculated Property |
| Inp | [2265.00; 2265.00] |
|
|
| Inp | 2265.00 | NIST | |
| Inp | 2265.00 | NIST | |
| Tboil | 631.15 | K | Relay (... Calculated Property |
| Tc | 825.16 | K | Relay (... Calculated Property |
| Tfus | 274.97 | K | Relay (... Calculated Property |
| Vc | 1.129 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [997.90; 1088.53] | J/mol×K | [848.58; 1047.72] |
|
| Cp,gas | 997.90 | J/mol×K | 848.58 | Joback Calculated Property |
| Cp,gas | 1015.93 | J/mol×K | 881.77 | Joback Calculated Property |
| Cp,gas | 1032.72 | J/mol×K | 914.96 | Joback Calculated Property |
| Cp,gas | 1048.33 | J/mol×K | 948.15 | Joback Calculated Property |
| Cp,gas | 1062.81 | J/mol×K | 981.34 | Joback Calculated Property |
| Cp,gas | 1076.20 | J/mol×K | 1014.53 | Joback Calculated Property |
| Cp,gas | 1088.53 | J/mol×K | 1047.72 | Joback Calculated Property |
| η | [0.0000536; 0.0008183] | Pa×s | [499.37; 848.58] |
|
| η | 0.0008183 | Pa×s | 499.37 | Joback Calculated Property |
| η | 0.0004098 | Pa×s | 557.57 | Joback Calculated Property |
| η | 0.0002339 | Pa×s | 615.77 | Joback Calculated Property |
| η | 0.0001471 | Pa×s | 673.97 | Joback Calculated Property |
| η | 0.0000995 | Pa×s | 732.18 | Joback Calculated Property |
| η | 0.0000714 | Pa×s | 790.38 | Joback Calculated Property |
| η | 0.0000536 | Pa×s | 848.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, octyl tetrahydrofurfuryl ester.
Sources
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