- InChI
- InChI=1S/C11H18O5/c1-3-15-9(12)11(10(13)16-4-2)5-7-14-8-6-11/h3-8H2,1-2H3
- InChI Key
- ILUMJWCFQOFDMA-UHFFFAOYSA-N
- Formula
- C11H18O5
- SMILES
- CCOC(=O)C1(C(=O)OCC)CCOCC1
- Molecular Weight1
- 230.26
- CAS
- 5382-77-4
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.5560 | Relay (1.0) Calculated Property | |
| ΔfG° | -493.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -930.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.68 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.909 | Crippen Calculated Property | |
| McVol | 175.740 | ml/mol | McGowan Calculated Property |
| Pc | 2654.29 | kPa | Joback Calculated Property |
| Tboil | 553.82 | K | Relay (1.0) Calculated Property |
| Tc | 744.11 | K | Relay (1.0) Calculated Property |
| Tfus | 302.41 | K | Relay (1.0) Calculated Property |
| Vc | 0.628 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [484.20; 568.68] | J/mol×K | [650.40; 863.92] | 
|
| Cp,gas | 484.20 | J/mol×K | 650.40 | Joback Calculated Property |
| Cp,gas | 500.02 | J/mol×K | 685.99 | Joback Calculated Property |
| Cp,gas | 515.04 | J/mol×K | 721.57 | Joback Calculated Property |
| Cp,gas | 529.33 | J/mol×K | 757.16 | Joback Calculated Property |
| Cp,gas | 542.99 | J/mol×K | 792.75 | Joback Calculated Property |
| Cp,gas | 556.08 | J/mol×K | 828.33 | Joback Calculated Property |
| Cp,gas | 568.68 | J/mol×K | 863.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethyl tetrahydropyran-4,4-dicarboxylate.
Sources
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