- InChI
- InChI=1S/C24H30O5/c1-3-4-5-6-7-10-16-28-23(25)21-14-8-9-15-22(21)24(26)29-18-19-12-11-13-20(17-19)27-2/h8-9,11-15,17H,3-7,10,16,18H2,1-2H3
- InChI Key
- GOZOCKQDMYCCFO-UHFFFAOYSA-N
- Formula
- C24H30O5
- SMILES
-
CCCCCCCCOC(=O)c1ccccc1C(=O)OCc
1cccc(OC)c1 - Molecular Weight1
- 398.49
- 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° | -216.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -710.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.62 | kJ/mol | Joback Calculated Property |
| log10WS | -7.12 | Crippen Calculated Property | |
| logPoct/wat | 5.569 | Crippen Calculated Property | |
| McVol | 322.250 | ml/mol | McGowan Calculated Property |
| Pc | 1261.95 | kPa | Joback Calculated Property |
| Inp | [3002.00; 3002.00] |
|
|
| Inp | 3002.00 | NIST | |
| Inp | 3002.00 | NIST | |
| Tboil | 986.84 | K | Joback Calculated Property |
| Tc | 1212.48 | K | Joback Calculated Property |
| Tfus | 604.67 | K | Joback Calculated Property |
| Vc | 1.230 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1043.07; 1100.29] | J/mol×K | [986.84; 1212.48] |
|
| Cp,gas | 1043.07 | J/mol×K | 986.84 | Joback Calculated Property |
| Cp,gas | 1056.42 | J/mol×K | 1024.45 | Joback Calculated Property |
| Cp,gas | 1068.21 | J/mol×K | 1062.05 | Joback Calculated Property |
| Cp,gas | 1078.46 | J/mol×K | 1099.66 | Joback Calculated Property |
| Cp,gas | 1087.20 | J/mol×K | 1137.27 | Joback Calculated Property |
| Cp,gas | 1094.47 | J/mol×K | 1174.87 | Joback Calculated Property |
| Cp,gas | 1100.29 | J/mol×K | 1212.48 | Joback Calculated Property |
| η | [0.0000241; 0.0002121] | Pa×s | [604.67; 986.84] |
|
| η | 0.0002121 | Pa×s | 604.67 | Joback Calculated Property |
| η | 0.0001242 | Pa×s | 668.37 | Joback Calculated Property |
| η | 0.0000799 | Pa×s | 732.06 | Joback Calculated Property |
| η | 0.0000551 | Pa×s | 795.75 | Joback Calculated Property |
| η | 0.0000402 | Pa×s | 859.45 | Joback Calculated Property |
| η | 0.0000306 | Pa×s | 923.14 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 986.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 3-methoxybenzyl octyl ester.
Sources
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