- InChI
- InChI=1S/C25H40O4/c1-4-5-6-11-14-20-28-24(26)18-12-9-7-8-10-13-19-25(27)29-23-17-15-16-21(2)22(23)3/h15-17H,4-14,18-20H2,1-3H3
- InChI Key
- XTBIBCSSYGKCSM-UHFFFAOYSA-N
- Formula
- C25H40O4
- SMILES
-
CCCCCCCOC(=O)CCCCCCCCC(=O)Oc1c
ccc(C)c1C - Molecular Weight1
- 404.58
- 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° | -215.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -835.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 59.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.16 | kJ/mol | Joback Calculated Property |
| log10WS | -7.88 | Crippen Calculated Property | |
| logPoct/wat | 6.843 | Crippen Calculated Property | |
| McVol | 354.230 | ml/mol | McGowan Calculated Property |
| Pc | 961.48 | kPa | Joback Calculated Property |
| Inp | [3034.00; 3034.00] |
|
|
| Inp | 3034.00 | NIST | |
| Inp | 3034.00 | NIST | |
| Tboil | 960.62 | K | Joback Calculated Property |
| Tc | 1176.07 | K | Joback Calculated Property |
| Tfus | 567.29 | K | Joback Calculated Property |
| Vc | 1.375 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1180.77; 1262.45] | J/mol×K | [960.62; 1176.07] |
|
| Cp,gas | 1180.77 | J/mol×K | 960.62 | Joback Calculated Property |
| Cp,gas | 1197.95 | J/mol×K | 996.53 | Joback Calculated Property |
| Cp,gas | 1213.65 | J/mol×K | 1032.44 | Joback Calculated Property |
| Cp,gas | 1227.92 | J/mol×K | 1068.35 | Joback Calculated Property |
| Cp,gas | 1240.78 | J/mol×K | 1104.25 | Joback Calculated Property |
| Cp,gas | 1252.28 | J/mol×K | 1140.16 | Joback Calculated Property |
| Cp,gas | 1262.45 | J/mol×K | 1176.07 | Joback Calculated Property |
| η | [0.0000271; 0.0003003] | Pa×s | [567.29; 960.62] |
|
| η | 0.0003003 | Pa×s | 567.29 | Joback Calculated Property |
| η | 0.0001634 | Pa×s | 632.84 | Joback Calculated Property |
| η | 0.0000997 | Pa×s | 698.40 | Joback Calculated Property |
| η | 0.0000662 | Pa×s | 763.95 | Joback Calculated Property |
| η | 0.0000469 | Pa×s | 829.51 | Joback Calculated Property |
| η | 0.0000349 | Pa×s | 895.06 | Joback Calculated Property |
| η | 0.0000271 | Pa×s | 960.62 | Joback Calculated Property |
Similar Compounds
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Sources
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