- InChI
- InChI=1S/C24H44O4/c1-3-5-7-9-10-12-16-20-28-24(26)22-18-14-13-17-21(22)23(25)27-19-15-11-8-6-4-2/h21-22H,3-20H2,1-2H3
- InChI Key
- YWRCIMHJSXWWRC-UHFFFAOYSA-N
- Formula
- C24H44O4
- SMILES
-
CCCCCCCCCOC(=O)C1CCCCC1C(=O)OC
CCCCCC - Molecular Weight1
- 396.60
- 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° | -299.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -994.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.45 | kJ/mol | Joback Calculated Property |
| log10WS | -7.01 | Crippen Calculated Property | |
| logPoct/wat | 6.600 | Crippen Calculated Property | |
| McVol | 353.040 | ml/mol | McGowan Calculated Property |
| Pc | 942.10 | kPa | Joback Calculated Property |
| Inp | [2717.00; 2717.00] |
|
|
| Inp | 2717.00 | NIST | |
| Inp | 2717.00 | NIST | |
| Tboil | 915.98 | K | Joback Calculated Property |
| Tc | 1121.76 | K | Joback Calculated Property |
| Tfus | 507.70 | K | Joback Calculated Property |
| Vc | 1.359 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1218.74; 1313.78] | J/mol×K | [915.98; 1121.76] |
|
| Cp,gas | 1218.74 | J/mol×K | 915.98 | Joback Calculated Property |
| Cp,gas | 1238.49 | J/mol×K | 950.28 | Joback Calculated Property |
| Cp,gas | 1256.64 | J/mol×K | 984.57 | Joback Calculated Property |
| Cp,gas | 1273.21 | J/mol×K | 1018.87 | Joback Calculated Property |
| Cp,gas | 1288.23 | J/mol×K | 1053.16 | Joback Calculated Property |
| Cp,gas | 1301.75 | J/mol×K | 1087.46 | Joback Calculated Property |
| Cp,gas | 1313.78 | J/mol×K | 1121.76 | Joback Calculated Property |
| η | [0.0000399; 0.0006525] | Pa×s | [507.70; 915.98] |
|
| η | 0.0006525 | Pa×s | 507.70 | Joback Calculated Property |
| η | 0.0003110 | Pa×s | 575.75 | Joback Calculated Property |
| η | 0.0001733 | Pa×s | 643.79 | Joback Calculated Property |
| η | 0.0001080 | Pa×s | 711.84 | Joback Calculated Property |
| η | 0.0000731 | Pa×s | 779.89 | Joback Calculated Property |
| η | 0.0000527 | Pa×s | 847.93 | Joback Calculated Property |
| η | 0.0000399 | Pa×s | 915.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, heptyl nonyl ester.
Sources
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