- InChI
- InChI=1S/C29H40O5/c1-24(2)13-12-22-32-28(30)16-10-5-3-4-6-11-17-29(31)33-23-25-18-20-27(21-19-25)34-26-14-8-7-9-15-26/h7-9,14-15,18-21,24H,3-6,10-13,16-17,22-23H2,1-2H3
- InChI Key
- MGTJTGCZNZETIS-UHFFFAOYSA-N
- Formula
- C29H40O5
- SMILES
-
CC(C)CCCOC(=O)CCCCCCCCC(=O)OCc
1ccc(Oc2ccccc2)cc1 - Molecular Weight1
- 468.62
- 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° | -166.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -807.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.70 | kJ/mol | Joback Calculated Property |
| log10WS | -8.17 | Crippen Calculated Property | |
| logPoct/wat | 7.622 | Crippen Calculated Property | |
| McVol | 392.700 | ml/mol | McGowan Calculated Property |
| Pc | 934.06 | kPa | Joback Calculated Property |
| Inp | 3527.00 | NIST | |
| Tboil | 1095.82 | K | Joback Calculated Property |
| Tc | 1343.28 | K | Joback Calculated Property |
| Tfus | 633.50 | K | Joback Calculated Property |
| Vc | 1.504 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1348.57; 1400.90] | J/mol×K | [1095.82; 1343.28] | 
|
| Cp,gas | 1348.57 | J/mol×K | 1095.82 | Joback Calculated Property |
| Cp,gas | 1361.96 | J/mol×K | 1137.06 | Joback Calculated Property |
| Cp,gas | 1373.38 | J/mol×K | 1178.31 | Joback Calculated Property |
| Cp,gas | 1382.91 | J/mol×K | 1219.55 | Joback Calculated Property |
| Cp,gas | 1390.63 | J/mol×K | 1260.79 | Joback Calculated Property |
| Cp,gas | 1396.60 | J/mol×K | 1302.03 | Joback Calculated Property |
| Cp,gas | 1400.90 | J/mol×K | 1343.28 | Joback Calculated Property |
| η | [0.0000099; 0.0001376] | Pa×s | [633.50; 1095.82] |
|
| η | 0.0001376 | Pa×s | 633.50 | Joback Calculated Property |
| η | 0.0000700 | Pa×s | 710.55 | Joback Calculated Property |
| η | 0.0000406 | Pa×s | 787.61 | Joback Calculated Property |
| η | 0.0000260 | Pa×s | 864.66 | Joback Calculated Property |
| η | 0.0000179 | Pa×s | 941.71 | Joback Calculated Property |
| η | 0.0000130 | Pa×s | 1018.77 | Joback Calculated Property |
| η | 0.0000099 | Pa×s | 1095.82 | Joback Calculated Property |
Similar Compounds
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Sources
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