- InChI
- InChI=1S/C33H64O4/c1-4-7-8-9-10-11-12-13-14-15-18-21-24-29-36-32(34)27-22-19-16-17-20-23-28-33(35)37-30-31(25-5-2)26-6-3/h31H,4-30H2,1-3H3
- InChI Key
- CATRYSQLGZOZLQ-UHFFFAOYSA-N
- Formula
- C33H64O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCCCCCCCC
(=O)OCC(CCC)CCC - Molecular Weight1
- 524.86
- 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° | -243.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1219.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 83.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.98 | kJ/mol | Joback Calculated Property |
| log10WS | -11.12 | Crippen Calculated Property | |
| logPoct/wat | 10.501 | Crippen Calculated Property | |
| McVol | 490.710 | ml/mol | McGowan Calculated Property |
| Pc | 544.37 | kPa | Joback Calculated Property |
| Inp | [2680.00; 2680.00] |
|
|
| Inp | 2680.00 | NIST | |
| Inp | 2680.00 | NIST | |
| Tboil | 1106.58 | K | Joback Calculated Property |
| Tc | 1421.70 | K | Joback Calculated Property |
| Tfus | 590.99 | K | Joback Calculated Property |
| Vc | 1.925 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1802.88; 1913.88] | J/mol×K | [1106.58; 1421.70] |
|
| Cp,gas | 1802.88 | J/mol×K | 1106.58 | Joback Calculated Property |
| Cp,gas | 1829.39 | J/mol×K | 1159.10 | Joback Calculated Property |
| Cp,gas | 1852.41 | J/mol×K | 1211.62 | Joback Calculated Property |
| Cp,gas | 1872.15 | J/mol×K | 1264.14 | Joback Calculated Property |
| Cp,gas | 1888.82 | J/mol×K | 1316.66 | Joback Calculated Property |
| Cp,gas | 1902.66 | J/mol×K | 1369.18 | Joback Calculated Property |
| Cp,gas | 1913.88 | J/mol×K | 1421.70 | Joback Calculated Property |
| η | [0.0000064; 0.0001733] | Pa×s | [590.99; 1106.58] |
|
| η | 0.0001733 | Pa×s | 590.99 | Joback Calculated Property |
| η | 0.0000704 | Pa×s | 676.92 | Joback Calculated Property |
| η | 0.0000351 | Pa×s | 762.85 | Joback Calculated Property |
| η | 0.0000201 | Pa×s | 848.78 | Joback Calculated Property |
| η | 0.0000128 | Pa×s | 934.72 | Joback Calculated Property |
| η | 0.0000087 | Pa×s | 1020.65 | Joback Calculated Property |
| η | 0.0000064 | Pa×s | 1106.58 | Joback Calculated Property |
Similar Compounds
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Sources
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