- InChI
- InChI=1S/C19H24O6/c1-5-9-14(6-2)24-17(20)12-8-13-18(21)25-19-15(22-3)10-7-11-16(19)23-4/h7,10-11,14H,6,8,12-13H2,1-4H3
- InChI Key
- HIZJIOYKEKCFAT-UHFFFAOYSA-N
- Formula
- C19H24O6
- SMILES
-
CC#CC(CC)OC(=O)CCCC(=O)Oc1c(OC
)cccc1OC - Molecular Weight1
- 348.39
- 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° | -275.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -708.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.38 | kJ/mol | Joback Calculated Property |
| log10WS | -4.56 | Crippen Calculated Property | |
| logPoct/wat | 3.125 | Crippen Calculated Property | |
| McVol | 272.830 | ml/mol | McGowan Calculated Property |
| Pc | 1580.97 | kPa | Joback Calculated Property |
| Inp | 2503.00 | NIST | |
| Tboil | 876.74 | K | Joback Calculated Property |
| Tc | 1092.44 | K | Joback Calculated Property |
| Tfus | 635.23 | K | Joback Calculated Property |
| Vc | 1.032 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [823.73; 887.66] | J/mol×K | [876.74; 1092.44] | 
|
| Cp,gas | 823.73 | J/mol×K | 876.74 | Joback Calculated Property |
| Cp,gas | 837.83 | J/mol×K | 912.69 | Joback Calculated Property |
| Cp,gas | 850.58 | J/mol×K | 948.64 | Joback Calculated Property |
| Cp,gas | 861.95 | J/mol×K | 984.59 | Joback Calculated Property |
| Cp,gas | 871.94 | J/mol×K | 1020.54 | Joback Calculated Property |
| Cp,gas | 880.51 | J/mol×K | 1056.49 | Joback Calculated Property |
| Cp,gas | 887.66 | J/mol×K | 1092.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hex-4-yn-3-yl 2,6-dimethoxyphenyl ester.
Sources
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