- InChI
- InChI=1S/C27H50O4/c1-3-5-7-8-9-10-11-12-13-14-15-19-23-31-27(29)25-21-17-16-20-24(25)26(28)30-22-18-6-4-2/h24-25H,3-23H2,1-2H3
- InChI Key
- KGBLWMYBBFJATI-UHFFFAOYSA-N
- Formula
- C27H50O4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)C1CCCCC1C(
=O)OCCCCC - Molecular Weight1
- 438.68
- 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° | -274.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1056.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 64.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.13 | kJ/mol | Joback Calculated Property |
| log10WS | -8.26 | Crippen Calculated Property | |
| logPoct/wat | 7.771 | Crippen Calculated Property | |
| McVol | 395.310 | ml/mol | McGowan Calculated Property |
| Pc | 795.28 | kPa | Joback Calculated Property |
| Inp | [3062.00; 3062.00] |
|
|
| Inp | 3062.00 | NIST | |
| Inp | 3062.00 | NIST | |
| Tboil | 984.62 | K | Joback Calculated Property |
| Tc | 1207.94 | K | Joback Calculated Property |
| Tfus | 541.51 | K | Joback Calculated Property |
| Vc | 1.528 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1410.41; 1504.00] | J/mol×K | [984.62; 1207.94] |
|
| Cp,gas | 1410.41 | J/mol×K | 984.62 | Joback Calculated Property |
| Cp,gas | 1430.75 | J/mol×K | 1021.84 | Joback Calculated Property |
| Cp,gas | 1449.13 | J/mol×K | 1059.06 | Joback Calculated Property |
| Cp,gas | 1465.59 | J/mol×K | 1096.28 | Joback Calculated Property |
| Cp,gas | 1480.19 | J/mol×K | 1133.50 | Joback Calculated Property |
| Cp,gas | 1492.98 | J/mol×K | 1170.72 | Joback Calculated Property |
| Cp,gas | 1504.00 | J/mol×K | 1207.94 | Joback Calculated Property |
| η | [0.0000254; 0.0004525] | Pa×s | [541.51; 984.62] |
|
| η | 0.0004525 | Pa×s | 541.51 | Joback Calculated Property |
| η | 0.0002099 | Pa×s | 615.36 | Joback Calculated Property |
| η | 0.0001148 | Pa×s | 689.21 | Joback Calculated Property |
| η | 0.0000706 | Pa×s | 763.07 | Joback Calculated Property |
| η | 0.0000473 | Pa×s | 836.92 | Joback Calculated Property |
| η | 0.0000338 | Pa×s | 910.77 | Joback Calculated Property |
| η | 0.0000254 | Pa×s | 984.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, pentyl tetradecyl ester.
Sources
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