- InChI
- InChI=1S/C26H38O5/c1-4-5-6-7-8-9-10-11-12-13-14-20-30-25(27)16-15-17-26(28)31-24-21-22(2)18-19-23(24)29-3/h18-19,21H,4-12,15-17,20H2,1-3H3
- InChI Key
- VRUPUOLJFYFORP-UHFFFAOYSA-N
- Formula
- C26H38O5
- SMILES
-
CCCCCCCCCCC#CCOC(=O)CCCC(=O)Oc
1cc(C)ccc1OC - Molecular Weight1
- 430.58
- 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° | -108.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -715.90 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.94 | kJ/mol | Joback Calculated Property |
| log10WS | -7.74 | Crippen Calculated Property | |
| logPoct/wat | 6.157 | Crippen Calculated Property | |
| McVol | 365.590 | ml/mol | McGowan Calculated Property |
| Pc | 990.13 | kPa | Joback Calculated Property |
| Inp | 3186.00 | NIST | |
| Tboil | 1014.92 | K | Joback Calculated Property |
| Tc | 1242.56 | K | Joback Calculated Property |
| Tfus | 706.89 | K | Joback Calculated Property |
| Vc | 1.411 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1214.95; 1280.45] | J/mol×K | [1014.92; 1242.56] | 
|
| Cp,gas | 1214.95 | J/mol×K | 1014.92 | Joback Calculated Property |
| Cp,gas | 1230.13 | J/mol×K | 1052.86 | Joback Calculated Property |
| Cp,gas | 1243.57 | J/mol×K | 1090.80 | Joback Calculated Property |
| Cp,gas | 1255.30 | J/mol×K | 1128.74 | Joback Calculated Property |
| Cp,gas | 1265.34 | J/mol×K | 1166.68 | Joback Calculated Property |
| Cp,gas | 1273.72 | J/mol×K | 1204.62 | Joback Calculated Property |
| Cp,gas | 1280.45 | J/mol×K | 1242.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, tridec-2-yn-1-yl 5-methyl-2-methoxybenzyl ester.
Sources
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