- InChI
- InChI=1S/C25H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-29-25(27)23-20-17-16-19-22(23)24(26)28-2/h22-23H,3-21H2,1-2H3
- InChI Key
- INIZGHVNWBSUAS-UHFFFAOYSA-N
- Formula
- C25H46O4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C1CCCCC1
C(=O)OC - Molecular Weight1
- 410.63
- 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° | -291.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1014.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.68 | kJ/mol | Joback Calculated Property |
| log10WS | -7.42 | Crippen Calculated Property | |
| logPoct/wat | 6.990 | Crippen Calculated Property | |
| McVol | 367.130 | ml/mol | McGowan Calculated Property |
| Pc | 888.94 | kPa | Joback Calculated Property |
| Inp | [2921.00; 2921.00] |
|
|
| Inp | 2921.00 | NIST | |
| Inp | 2921.00 | NIST | |
| Tboil | 938.86 | K | Joback Calculated Property |
| Tc | 1149.44 | K | Joback Calculated Property |
| Tfus | 518.97 | K | Joback Calculated Property |
| Vc | 1.415 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1282.28; 1376.92] | J/mol×K | [938.86; 1149.44] |
|
| Cp,gas | 1282.28 | J/mol×K | 938.86 | Joback Calculated Property |
| Cp,gas | 1302.20 | J/mol×K | 973.96 | Joback Calculated Property |
| Cp,gas | 1320.41 | J/mol×K | 1009.05 | Joback Calculated Property |
| Cp,gas | 1336.95 | J/mol×K | 1044.15 | Joback Calculated Property |
| Cp,gas | 1351.86 | J/mol×K | 1079.25 | Joback Calculated Property |
| Cp,gas | 1365.17 | J/mol×K | 1114.35 | Joback Calculated Property |
| Cp,gas | 1376.92 | J/mol×K | 1149.44 | Joback Calculated Property |
| η | [0.0000344; 0.0005793] | Pa×s | [518.97; 938.86] |
|
| η | 0.0005793 | Pa×s | 518.97 | Joback Calculated Property |
| η | 0.0002735 | Pa×s | 588.95 | Joback Calculated Property |
| η | 0.0001515 | Pa×s | 658.93 | Joback Calculated Property |
| η | 0.0000939 | Pa×s | 728.91 | Joback Calculated Property |
| η | 0.0000634 | Pa×s | 798.90 | Joback Calculated Property |
| η | 0.0000455 | Pa×s | 868.88 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 938.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, hexadecyl methyl ester.
Sources
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