- InChI
- InChI=1S/C17H28O5/c1-2-3-10-21-16(18)14-8-4-5-9-15(14)17(19)22-12-13-7-6-11-20-13/h13-15H,2-12H2,1H3
- InChI Key
- WEXOBQVQMZSOEI-UHFFFAOYSA-N
- Formula
- C17H28O5
- SMILES
-
CCCCOC(=O)C1CCCCC1C(=O)OCC1CCC
O1 - Molecular Weight1
- 312.40
- 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° | -408.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -921.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.64 | kJ/mol | Joback Calculated Property |
| log10WS | -3.17 | Crippen Calculated Property | |
| logPoct/wat | 2.858 | Crippen Calculated Property | |
| McVol | 249.420 | ml/mol | McGowan Calculated Property |
| Pc | 1714.61 | kPa | Joback Calculated Property |
| Inp | [2218.00; 2218.00] |
|
|
| Inp | 2218.00 | NIST | |
| Inp | 2218.00 | NIST | |
| Tboil | 798.05 | K | Joback Calculated Property |
| Tc | 1011.49 | K | Joback Calculated Property |
| Tfus | 466.28 | K | Joback Calculated Property |
| Vc | 0.929 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [816.88; 909.64] | J/mol×K | [798.05; 1011.49] |
|
| Cp,gas | 816.88 | J/mol×K | 798.05 | Joback Calculated Property |
| Cp,gas | 836.02 | J/mol×K | 833.62 | Joback Calculated Property |
| Cp,gas | 853.65 | J/mol×K | 869.20 | Joback Calculated Property |
| Cp,gas | 869.81 | J/mol×K | 904.77 | Joback Calculated Property |
| Cp,gas | 884.52 | J/mol×K | 940.34 | Joback Calculated Property |
| Cp,gas | 897.79 | J/mol×K | 975.92 | Joback Calculated Property |
| Cp,gas | 909.64 | J/mol×K | 1011.49 | Joback Calculated Property |
| η | [0.0001371; 0.0014714] | Pa×s | [466.28; 798.05] |
|
| η | 0.0014714 | Pa×s | 466.28 | Joback Calculated Property |
| η | 0.0008033 | Pa×s | 521.57 | Joback Calculated Property |
| η | 0.0004925 | Pa×s | 576.87 | Joback Calculated Property |
| η | 0.0003289 | Pa×s | 632.16 | Joback Calculated Property |
| η | 0.0002344 | Pa×s | 687.46 | Joback Calculated Property |
| η | 0.0001757 | Pa×s | 742.75 | Joback Calculated Property |
| η | 0.0001371 | Pa×s | 798.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, butyl furfuryl ester.
Sources
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