- InChI
- InChI=1S/C26H34O6/c27-25(31-21-19-29-23-13-7-5-8-14-23)17-11-3-1-2-4-12-18-26(28)32-22-20-30-24-15-9-6-10-16-24/h5-10,13-16H,1-4,11-12,17-22H2
- InChI Key
- CCOHSRRJVBDUOH-UHFFFAOYSA-N
- Formula
- C26H34O6
- SMILES
-
O=C(CCCCCCCCC(=O)OCCOc1ccccc1)
OCCOc1ccccc1 - Molecular Weight1
- 442.54
- 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° | -284.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -860.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 59.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.15 | kJ/mol | Joback Calculated Property |
| log10WS | -6.11 | Crippen Calculated Property | |
| logPoct/wat | 5.352 | Crippen Calculated Property | |
| McVol | 356.300 | ml/mol | McGowan Calculated Property |
| Pc | 1115.57 | kPa | Joback Calculated Property |
| Inp | [3402.00; 3402.00] |
|
|
| Inp | 3402.00 | NIST | |
| Inp | 3402.00 | NIST | |
| Tboil | 1045.06 | K | Joback Calculated Property |
| Tc | 1279.45 | K | Joback Calculated Property |
| Tfus | 624.40 | K | Joback Calculated Property |
| Vc | 1.359 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1192.41; 1240.18] | J/mol×K | [1045.06; 1279.45] |
|
| Cp,gas | 1192.41 | J/mol×K | 1045.06 | Joback Calculated Property |
| Cp,gas | 1204.88 | J/mol×K | 1084.13 | Joback Calculated Property |
| Cp,gas | 1215.49 | J/mol×K | 1123.19 | Joback Calculated Property |
| Cp,gas | 1224.28 | J/mol×K | 1162.26 | Joback Calculated Property |
| Cp,gas | 1231.30 | J/mol×K | 1201.32 | Joback Calculated Property |
| Cp,gas | 1236.59 | J/mol×K | 1240.39 | Joback Calculated Property |
| Cp,gas | 1240.18 | J/mol×K | 1279.45 | Joback Calculated Property |
| η | [0.0000124; 0.0001446] | Pa×s | [624.40; 1045.06] |
|
| η | 0.0001446 | Pa×s | 624.40 | Joback Calculated Property |
| η | 0.0000781 | Pa×s | 694.51 | Joback Calculated Property |
| η | 0.0000473 | Pa×s | 764.62 | Joback Calculated Property |
| η | 0.0000311 | Pa×s | 834.73 | Joback Calculated Property |
| η | 0.0000219 | Pa×s | 904.84 | Joback Calculated Property |
| η | 0.0000162 | Pa×s | 974.95 | Joback Calculated Property |
| η | 0.0000124 | Pa×s | 1045.06 | Joback Calculated Property |
Similar Compounds
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Sources
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