- InChI
- InChI=1S/C26H52O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-28-26(27)23-22-25(2)3/h25H,4-24H2,1-3H3
- InChI Key
- AMCTXVWODKMXND-UHFFFAOYSA-N
- Formula
- C26H52O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCOC(=O)CCC(
C)C - Molecular Weight1
- 396.70
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1482 | Relay (1.0) Calculated Property | |
| ΔfG° | -144.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -904.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 63.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.59 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.008 | Crippen Calculated Property | |
| McVol | 384.640 | ml/mol | McGowan Calculated Property |
| Pc | 730.07 | kPa | Joback Calculated Property |
| Inp | [2733.00; 2733.00] |
|
|
| Inp | 2733.00 | NIST | |
| Inp | 2733.00 | NIST | |
| Tboil | 631.33 | K | Relay (1.0) Calculated Property |
| Tc | 816.69 | K | Relay (1.0) Calculated Property |
| Tfus | 293.21 | K | Relay (1.0) Calculated Property |
| Vc | 1.500 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1274.95; 1392.36] | J/mol×K | [852.26; 1043.98] |
|
| Cp,gas | 1274.95 | J/mol×K | 852.26 | Joback Calculated Property |
| Cp,gas | 1297.73 | J/mol×K | 884.21 | Joback Calculated Property |
| Cp,gas | 1319.17 | J/mol×K | 916.17 | Joback Calculated Property |
| Cp,gas | 1339.30 | J/mol×K | 948.12 | Joback Calculated Property |
| Cp,gas | 1358.18 | J/mol×K | 980.07 | Joback Calculated Property |
| Cp,gas | 1375.85 | J/mol×K | 1012.03 | Joback Calculated Property |
| Cp,gas | 1392.36 | J/mol×K | 1043.98 | Joback Calculated Property |
| η | [0.0000250; 0.0014091] | Pa×s | [410.11; 852.26] |
|
| η | 0.0014091 | Pa×s | 410.11 | Joback Calculated Property |
| η | 0.0004315 | Pa×s | 483.80 | Joback Calculated Property |
| η | 0.0001807 | Pa×s | 557.49 | Joback Calculated Property |
| η | 0.0000927 | Pa×s | 631.18 | Joback Calculated Property |
| η | 0.0000547 | Pa×s | 704.88 | Joback Calculated Property |
| η | 0.0000357 | Pa×s | 778.57 | Joback Calculated Property |
| η | 0.0000250 | Pa×s | 852.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Eicosyl 4-methylpentanoate.
Sources
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