- InChI
- InChI=1S/C26H52O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(27)29-25(2)24-28-3/h25H,4-24H2,1-3H3
- InChI Key
- OLPWCQVTDGVJNQ-UHFFFAOYSA-N
- Formula
- C26H52O3
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C
)COC - Molecular Weight1
- 412.69
- 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 | 1.1803 | Relay (... Calculated Property | |
| ΔfG° | -173.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1018.95 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 63.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.40 | kJ/mol | Relay (... Calculated Property |
| IE | 9.93 | eV | Relay (... Calculated Property |
| log10WS | -8.03 | Relay (... Calculated Property | |
| logPoct/wat | 8.386 | Crippen Calculated Property | |
| McVol | 390.510 | ml/mol | McGowan Calculated Property |
| Pc | 739.63 | kPa | Joback Calculated Property |
| Inp | [2792.00; 2792.00] |
|
|
| Inp | 2792.00 | NIST | |
| Inp | 2792.00 | NIST | |
| Tboil | 635.73 | K | Relay (... Calculated Property |
| Tc | 823.85 | K | Relay (... Calculated Property |
| Tfus | 316.63 | K | Relay (... Calculated Property |
| Vc | 1.516 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1320.14; 1434.88] | J/mol×K | [892.55; 1095.41] |
|
| Cp,gas | 1320.14 | J/mol×K | 892.55 | Joback Calculated Property |
| Cp,gas | 1342.87 | J/mol×K | 926.36 | Joback Calculated Property |
| Cp,gas | 1364.10 | J/mol×K | 960.17 | Joback Calculated Property |
| Cp,gas | 1383.88 | J/mol×K | 993.98 | Joback Calculated Property |
| Cp,gas | 1402.24 | J/mol×K | 1027.79 | Joback Calculated Property |
| Cp,gas | 1419.23 | J/mol×K | 1061.60 | Joback Calculated Property |
| Cp,gas | 1434.88 | J/mol×K | 1095.41 | Joback Calculated Property |
| η | [0.0000211; 0.0006499] | Pa×s | [462.17; 892.55] |
|
| η | 0.0006499 | Pa×s | 462.17 | Joback Calculated Property |
| η | 0.0002500 | Pa×s | 533.90 | Joback Calculated Property |
| η | 0.0001206 | Pa×s | 605.63 | Joback Calculated Property |
| η | 0.0000679 | Pa×s | 677.36 | Joback Calculated Property |
| η | 0.0000426 | Pa×s | 749.09 | Joback Calculated Property |
| η | 0.0000291 | Pa×s | 820.82 | Joback Calculated Property |
| η | 0.0000211 | Pa×s | 892.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Methyl-2-methoxyethyl behenoate.
Sources
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