- InChI
- InChI=1S/C15H22O4/c1-5-7-13(6-2)19-15(17)9-8-14(16)18-11-10-12(3)4/h13H,3,6,8-11H2,1-2,4H3
- InChI Key
- UOJDEVCATSGCHR-UHFFFAOYSA-N
- Formula
- C15H22O4
- SMILES
-
C=C(C)CCOC(=O)CCC(=O)OC(C#CC)C
C - Molecular Weight1
- 266.33
- 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).
- 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° | -112.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -459.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.47 | kJ/mol | Joback Calculated Property |
| log10WS | -3.59 | Crippen Calculated Property | |
| logPoct/wat | 2.621 | Crippen Calculated Property | |
| McVol | 224.190 | ml/mol | McGowan Calculated Property |
| Pc | 1809.23 | kPa | Joback Calculated Property |
| Inp | [1799.00; 1799.00] |
|
|
| Inp | 1799.00 | NIST | |
| Inp | 1799.00 | NIST | |
| Tboil | 700.30 | K | Joback Calculated Property |
| Tc | 898.20 | K | Joback Calculated Property |
| Tfus | 478.51 | K | Joback Calculated Property |
| Vc | 0.862 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [608.99; 689.04] | J/mol×K | [700.30; 898.20] |
|
| Cp,gas | 608.99 | J/mol×K | 700.30 | Joback Calculated Property |
| Cp,gas | 624.41 | J/mol×K | 733.28 | Joback Calculated Property |
| Cp,gas | 638.98 | J/mol×K | 766.27 | Joback Calculated Property |
| Cp,gas | 652.73 | J/mol×K | 799.25 | Joback Calculated Property |
| Cp,gas | 665.65 | J/mol×K | 832.23 | Joback Calculated Property |
| Cp,gas | 677.75 | J/mol×K | 865.21 | Joback Calculated Property |
| Cp,gas | 689.04 | J/mol×K | 898.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, hex-4-yn-3-yl 3-methylbut-3-en-1-yl ester.
Sources
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