- InChI
- InChI=1S/C15H20O4/c1-5-8-13(9-6-2)19-15(17)11-10-14(16)18-12(4)7-3/h3,5-6,12-13H,1-2,8-11H2,4H3
- InChI Key
- NHVZZCZEGOUFQM-UHFFFAOYSA-N
- Formula
- C15H20O4
- SMILES
-
C#CC(C)OC(=O)CCC(=O)OC(CC=C)CC
=C - Molecular Weight1
- 264.32
- 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° | 1.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -310.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.04 | kJ/mol | Joback Calculated Property |
| log10WS | -3.55 | Crippen Calculated Property | |
| logPoct/wat | 2.395 | Crippen Calculated Property | |
| McVol | 219.890 | ml/mol | McGowan Calculated Property |
| Pc | 1861.11 | kPa | Joback Calculated Property |
| Inp | [1671.00; 1671.00] |
|
|
| Inp | 1671.00 | NIST | |
| Inp | 1671.00 | NIST | |
| Tboil | 677.78 | K | Joback Calculated Property |
| Tc | 871.32 | K | Joback Calculated Property |
| Tfus | 416.58 | K | Joback Calculated Property |
| Vc | 0.836 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [583.16; 658.74] | J/mol×K | [677.78; 871.32] |
|
| Cp,gas | 583.16 | J/mol×K | 677.78 | Joback Calculated Property |
| Cp,gas | 597.70 | J/mol×K | 710.04 | Joback Calculated Property |
| Cp,gas | 611.44 | J/mol×K | 742.29 | Joback Calculated Property |
| Cp,gas | 624.39 | J/mol×K | 774.55 | Joback Calculated Property |
| Cp,gas | 636.58 | J/mol×K | 806.81 | Joback Calculated Property |
| Cp,gas | 648.02 | J/mol×K | 839.06 | Joback Calculated Property |
| Cp,gas | 658.74 | J/mol×K | 871.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, but-3-yn-2-yl hept-1,6-dien-4-yl ester.
Sources
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