- InChI
- InChI=1S/C17H30O5/c1-4-7-8-11-21-15(18)17(5-2,6-3)16(19)22-13-14-10-9-12-20-14/h14H,4-13H2,1-3H3
- InChI Key
- IMLKFDBVHWPKQR-UHFFFAOYSA-N
- Formula
- C17H30O5
- SMILES
-
CCCCCOC(=O)C(CC)(CC)C(=O)OCC1C
CCO1 - Molecular Weight1
- 314.42
- 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 | 0.7783 | Relay (1.0) Calculated Property | |
| ΔfG° | -422.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1060.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.77 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.248 | Crippen Calculated Property | |
| McVol | 260.280 | ml/mol | McGowan Calculated Property |
| Pc | 1516.39 | kPa | Joback Calculated Property |
| Inp | 1971.00 | NIST | |
| Tboil | 606.97 | K | Relay (1.0) Calculated Property |
| Tc | 798.22 | K | Relay (1.0) Calculated Property |
| Tfus | 268.29 | K | Relay (1.0) Calculated Property |
| Vc | 0.965 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [819.34; 908.18] | J/mol×K | [779.94; 978.20] | 
|
| Cp,gas | 819.34 | J/mol×K | 779.94 | Joback Calculated Property |
| Cp,gas | 836.87 | J/mol×K | 812.98 | Joback Calculated Property |
| Cp,gas | 853.27 | J/mol×K | 846.03 | Joback Calculated Property |
| Cp,gas | 868.56 | J/mol×K | 879.07 | Joback Calculated Property |
| Cp,gas | 882.79 | J/mol×K | 912.12 | Joback Calculated Property |
| Cp,gas | 895.98 | J/mol×K | 945.16 | Joback Calculated Property |
| Cp,gas | 908.18 | J/mol×K | 978.20 | Joback Calculated Property |
| η | [0.0000842; 0.0011563] | Pa×s | [465.56; 779.94] |
|
| η | 0.0011563 | Pa×s | 465.56 | Joback Calculated Property |
| η | 0.0005991 | Pa×s | 517.96 | Joback Calculated Property |
| η | 0.0003503 | Pa×s | 570.35 | Joback Calculated Property |
| η | 0.0002242 | Pa×s | 622.75 | Joback Calculated Property |
| η | 0.0001537 | Pa×s | 675.15 | Joback Calculated Property |
| η | 0.0001113 | Pa×s | 727.54 | Joback Calculated Property |
| η | 0.0000842 | Pa×s | 779.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, pentyl tetrahydrofurfuryl ester.
Sources
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