- InChI
- InChI=1S/C26H50O5/c1-5-6-11-16-24(19-21-29-4)22-31-26(28)18-13-10-8-7-9-12-17-25(27)30-20-14-15-23(2)3/h23-24H,5-22H2,1-4H3
- InChI Key
- SBTVYJPQFAIHKZ-UHFFFAOYSA-N
- Formula
- C26H50O5
- SMILES
-
CCCCCC(CCOC)COC(=O)CCCCCCCCC(=
O)OCCCC(C)C - Molecular Weight1
- 442.67
- 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 | 1.1928 | Relay (1.0) Calculated Property | |
| ΔfG° | -409.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1322.62 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 62.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.84 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.863 | Crippen Calculated Property | |
| McVol | 397.950 | ml/mol | McGowan Calculated Property |
| Pc | 761.84 | kPa | Joback Calculated Property |
| Inp | 2972.00 | NIST | |
| Tboil | 667.56 | K | Relay (1.0) Calculated Property |
| Tc | 829.77 | K | Relay (1.0) Calculated Property |
| Tfus | 255.90 | K | Relay (1.0) Calculated Property |
| Vc | 1.490 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1377.84; 1473.33] | J/mol×K | [968.40; 1193.44] | 
|
| Cp,gas | 1377.84 | J/mol×K | 968.40 | Joback Calculated Property |
| Cp,gas | 1398.42 | J/mol×K | 1005.91 | Joback Calculated Property |
| Cp,gas | 1417.09 | J/mol×K | 1043.41 | Joback Calculated Property |
| Cp,gas | 1433.87 | J/mol×K | 1080.92 | Joback Calculated Property |
| Cp,gas | 1448.82 | J/mol×K | 1118.43 | Joback Calculated Property |
| Cp,gas | 1461.96 | J/mol×K | 1155.94 | Joback Calculated Property |
| Cp,gas | 1473.33 | J/mol×K | 1193.44 | Joback Calculated Property |
| η | [0.0000132; 0.0003561] | Pa×s | [519.33; 968.40] |
|
| η | 0.0003561 | Pa×s | 519.33 | Joback Calculated Property |
| η | 0.0001454 | Pa×s | 594.17 | Joback Calculated Property |
| η | 0.0000725 | Pa×s | 669.02 | Joback Calculated Property |
| η | 0.0000416 | Pa×s | 743.87 | Joback Calculated Property |
| η | 0.0000264 | Pa×s | 818.71 | Joback Calculated Property |
| η | 0.0000181 | Pa×s | 893.56 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 968.40 | Joback Calculated Property |
Similar Compounds
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Sources
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