- InChI
- InChI=1S/C16H28O5/c1-13(2)6-4-11-20-15(17)8-3-9-16(18)21-12-14-7-5-10-19-14/h13-14H,3-12H2,1-2H3
- InChI Key
- FHIUYEAYXMPKGS-UHFFFAOYSA-N
- Formula
- C16H28O5
- SMILES
-
CC(C)CCCOC(=O)CCCC(=O)OCC1CCCO
1 - Molecular Weight1
- 300.39
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | -436.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -939.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.90 | kJ/mol | Joback Calculated Property |
| log10WS | -3.10 | Crippen Calculated Property | |
| logPoct/wat | 2.858 | Crippen Calculated Property | |
| McVol | 246.190 | ml/mol | McGowan Calculated Property |
| Pc | 1621.98 | kPa | Joback Calculated Property |
| Inp | [2177.00; 2177.00] |
|
|
| Inp | 2177.00 | NIST | |
| Inp | 2177.00 | NIST | |
| Tboil | 759.85 | K | Joback Calculated Property |
| Tc | 954.50 | K | Joback Calculated Property |
| Tfus | 436.87 | K | Joback Calculated Property |
| Vc | 0.935 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [760.27; 847.95] | J/mol×K | [759.85; 954.50] |
|
| Cp,gas | 760.27 | J/mol×K | 759.85 | Joback Calculated Property |
| Cp,gas | 777.51 | J/mol×K | 792.29 | Joback Calculated Property |
| Cp,gas | 793.67 | J/mol×K | 824.73 | Joback Calculated Property |
| Cp,gas | 808.78 | J/mol×K | 857.18 | Joback Calculated Property |
| Cp,gas | 822.85 | J/mol×K | 889.62 | Joback Calculated Property |
| Cp,gas | 835.90 | J/mol×K | 922.06 | Joback Calculated Property |
| Cp,gas | 847.95 | J/mol×K | 954.50 | Joback Calculated Property |
| η | [0.0001098; 0.0015619] | Pa×s | [436.87; 759.85] |
|
| η | 0.0015619 | Pa×s | 436.87 | Joback Calculated Property |
| η | 0.0007871 | Pa×s | 490.70 | Joback Calculated Property |
| η | 0.0004542 | Pa×s | 544.53 | Joback Calculated Property |
| η | 0.0002894 | Pa×s | 598.36 | Joback Calculated Property |
| η | 0.0001986 | Pa×s | 652.19 | Joback Calculated Property |
| η | 0.0001443 | Pa×s | 706.02 | Joback Calculated Property |
| η | 0.0001098 | Pa×s | 759.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, isohexyl tetrahydrofurfuryl ester.
Sources
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