- InChI
- InChI=1S/C25H42O4/c1-6-8-9-10-11-12-13-20-28-24(26)16-14-17-25(27)29-23(19-18-21(3)4)22(5)15-7-2/h22-23H,3,6-17,20H2,1-2,4-5H3
- InChI Key
- SZWABNDXIVFPMI-UHFFFAOYSA-N
- Formula
- C25H42O4
- SMILES
-
C=C(C)C#CC(OC(=O)CCCC(=O)OCCCC
CCCCC)C(C)CCC - Molecular Weight1
- 406.60
- 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° | -31.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -671.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 59.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.34 | kJ/mol | Joback Calculated Property |
| log10WS | -7.53 | Crippen Calculated Property | |
| logPoct/wat | 6.378 | Crippen Calculated Property | |
| McVol | 365.090 | ml/mol | McGowan Calculated Property |
| Pc | 916.61 | kPa | Joback Calculated Property |
| Inp | 2650.00 | NIST | |
| Tboil | 928.66 | K | Joback Calculated Property |
| Tc | 1137.11 | K | Joback Calculated Property |
| Tfus | 576.21 | K | Joback Calculated Property |
| Vc | 1.415 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1198.70; 1290.28] | J/mol×K | [928.66; 1137.11] | 
|
| Cp,gas | 1198.70 | J/mol×K | 928.66 | Joback Calculated Property |
| Cp,gas | 1217.25 | J/mol×K | 963.40 | Joback Calculated Property |
| Cp,gas | 1234.43 | J/mol×K | 998.14 | Joback Calculated Property |
| Cp,gas | 1250.29 | J/mol×K | 1032.88 | Joback Calculated Property |
| Cp,gas | 1264.86 | J/mol×K | 1067.63 | Joback Calculated Property |
| Cp,gas | 1278.17 | J/mol×K | 1102.37 | Joback Calculated Property |
| Cp,gas | 1290.28 | J/mol×K | 1137.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl nonyl ester.
Sources
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