- InChI
- InChI=1S/C40H80O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-42-40(41)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-39H2,1-2H3
- InChI Key
- VJFBRZCPEBSUHG-UHFFFAOYSA-N
- Formula
- C40H80O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCOC(=O)CCCC
CCCCCCCCCCCCCCC - Molecular Weight1
- 593.06
- CAS
- 22432-80-0
- Other Names
-
- Eicosyl eicosanoate
- eicosanyl eicosanoate
- icosyl icosanoate
- 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° | 52.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1113.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 102.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.79 | kJ/mol | Joback Calculated Property |
| log10WS | -15.43 | Crippen Calculated Property | |
| logPoct/wat | 14.613 | Crippen Calculated Property | |
| McVol | 581.900 | ml/mol | McGowan Calculated Property |
| Pc | 398.09 | kPa | Joback Calculated Property |
| Inp | [4146.16; 4146.16] |
|
|
| Inp | 4146.16 | NIST | |
| Inp | 4146.16 | NIST | |
| Tboil | 1190.89 | K | Joback Calculated Property |
| Tc | 1638.25 | K | Joback Calculated Property |
| Tfus | 612.72 | K | Joback Calculated Property |
| Vc | 2.300 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [2229.58; 2416.46] | J/mol×K | [1190.89; 1638.25] |
|
| Cp,gas | 2229.58 | J/mol×K | 1190.89 | Joback Calculated Property |
| Cp,gas | 2271.31 | J/mol×K | 1265.45 | Joback Calculated Property |
| Cp,gas | 2307.48 | J/mol×K | 1340.01 | Joback Calculated Property |
| Cp,gas | 2339.08 | J/mol×K | 1414.57 | Joback Calculated Property |
| Cp,gas | 2367.11 | J/mol×K | 1489.13 | Joback Calculated Property |
| Cp,gas | 2392.58 | J/mol×K | 1563.69 | Joback Calculated Property |
| Cp,gas | 2416.46 | J/mol×K | 1638.25 | Joback Calculated Property |
| η | [0.0000033; 0.0001118] | Pa×s | [612.72; 1190.89] |
|
| η | 0.0001118 | Pa×s | 612.72 | Joback Calculated Property |
| η | 0.0000417 | Pa×s | 709.08 | Joback Calculated Property |
| η | 0.0000197 | Pa×s | 805.44 | Joback Calculated Property |
| η | 0.0000109 | Pa×s | 901.80 | Joback Calculated Property |
| η | 0.0000068 | Pa×s | 998.17 | Joback Calculated Property |
| η | 0.0000046 | Pa×s | 1094.53 | Joback Calculated Property |
| η | 0.0000033 | Pa×s | 1190.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Eicosanoic acid, eicosyl ester.
Sources
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