- InChI
- InChI=1S/C17H24O4/c1-5-10-14(7-3)20-16(18)12-9-13-17(19)21-15(8-4)11-6-2/h14-15H,7-9,12-13H2,1-4H3
- InChI Key
- QDYORRCHHWXTAI-UHFFFAOYSA-N
- Formula
- C17H24O4
- SMILES
-
CC#CC(CC)OC(=O)CCCC(=O)OC(C#CC
)CC - Molecular Weight1
- 292.37
- 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).
- 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 | 0.6506 | Relay (... Calculated Property | |
| ΔfG° | 25.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -531.81 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 44.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.13 | kJ/mol | Relay (... Calculated Property |
| IE | 9.03 | eV | Relay (... Calculated Property |
| log10WS | -3.39 | Relay (... Calculated Property | |
| logPoct/wat | 2.847 | Crippen Calculated Property | |
| McVol | 248.070 | ml/mol | McGowan Calculated Property |
| Pc | 1704.71 | kPa | Joback Calculated Property |
| Inp | 2036.00 | NIST | |
| Tboil | 557.75 | K | Relay (... Calculated Property |
| Tc | 759.03 | K | Relay (... Calculated Property |
| Tfus | 319.14 | K | Relay (... Calculated Property |
| Vc | 0.871 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [698.07; 780.47] | J/mol×K | [758.06; 966.95] | 
|
| Cp,gas | 698.07 | J/mol×K | 758.06 | Joback Calculated Property |
| Cp,gas | 714.30 | J/mol×K | 792.87 | Joback Calculated Property |
| Cp,gas | 729.53 | J/mol×K | 827.69 | Joback Calculated Property |
| Cp,gas | 743.75 | J/mol×K | 862.50 | Joback Calculated Property |
| Cp,gas | 756.98 | J/mol×K | 897.32 | Joback Calculated Property |
| Cp,gas | 769.22 | J/mol×K | 932.13 | Joback Calculated Property |
| Cp,gas | 780.47 | J/mol×K | 966.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, di(hex-4-yn-3-yl) ester.
Sources
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