- InChI
- InChI=1S/C29H40O5/c1-4-7-8-9-10-11-15-21-32-27(30)29(5-2,6-3)28(31)33-23-24-17-16-20-26(22-24)34-25-18-13-12-14-19-25/h12-14,16-20,22H,4-11,15,21,23H2,1-3H3
- InChI Key
- HJCGIGCOJMICQJ-UHFFFAOYSA-N
- Formula
- C29H40O5
- SMILES
-
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)O
Cc1cccc(Oc2ccccc2)c1 - Molecular Weight1
- 468.62
- 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 | 1.1442 | Relay (1.0) Calculated Property | |
| ΔfG° | -161.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -886.71 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 131.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.622 | Crippen Calculated Property | |
| McVol | 392.700 | ml/mol | McGowan Calculated Property |
| Pc | 940.37 | kPa | Joback Calculated Property |
| Inp | 3190.00 | NIST | |
| Tboil | 723.25 | K | Relay (1.0) Calculated Property |
| Tc | 958.89 | K | Relay (1.0) Calculated Property |
| Tfus | 301.43 | K | Relay (1.0) Calculated Property |
| Vc | 1.416 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1348.99; 1409.79] | J/mol×K | [1093.03; 1338.68] | 
|
| Cp,gas | 1348.99 | J/mol×K | 1093.03 | Joback Calculated Property |
| Cp,gas | 1362.99 | J/mol×K | 1133.97 | Joback Calculated Property |
| Cp,gas | 1375.31 | J/mol×K | 1174.91 | Joback Calculated Property |
| Cp,gas | 1386.04 | J/mol×K | 1215.85 | Joback Calculated Property |
| Cp,gas | 1395.30 | J/mol×K | 1256.79 | Joback Calculated Property |
| Cp,gas | 1403.18 | J/mol×K | 1297.74 | Joback Calculated Property |
| Cp,gas | 1409.79 | J/mol×K | 1338.68 | Joback Calculated Property |
| η | [0.0000081; 0.0001066] | Pa×s | [650.92; 1093.03] |
|
| η | 0.0001066 | Pa×s | 650.92 | Joback Calculated Property |
| η | 0.0000557 | Pa×s | 724.61 | Joback Calculated Property |
| η | 0.0000328 | Pa×s | 798.29 | Joback Calculated Property |
| η | 0.0000211 | Pa×s | 871.98 | Joback Calculated Property |
| η | 0.0000146 | Pa×s | 945.66 | Joback Calculated Property |
| η | 0.0000106 | Pa×s | 1019.35 | Joback Calculated Property |
| η | 0.0000081 | Pa×s | 1093.03 | Joback Calculated Property |
Similar Compounds
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Sources
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