- InChI
- InChI=1S/C34H58O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-26-37-32(35)30-24-21-22-25-31(30)33(36)38-28-29(2)27-34(3,4)5/h21-22,24-25,29H,6-20,23,26-28H2,1-5H3
- InChI Key
- YCWOUWJQUNXFGN-UHFFFAOYSA-N
- Formula
- C34H58O4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)c1cccc
c1C(=O)OCC(C)CC(C)(C)C - Molecular Weight1
- 530.82
- 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° | -129.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1023.66 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 72.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.84 | kJ/mol | Joback Calculated Property |
| log10WS | -11.52 | Crippen Calculated Property | |
| logPoct/wat | 10.334 | Crippen Calculated Property | |
| McVol | 481.040 | ml/mol | McGowan Calculated Property |
| Pc | 610.57 | kPa | Joback Calculated Property |
| Inp | 3498.00 | NIST | |
| Tboil | 1157.89 | K | Joback Calculated Property |
| Tc | 1453.05 | K | Joback Calculated Property |
| Tfus | 643.62 | K | Joback Calculated Property |
| Vc | 1.863 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1755.10; 1851.24] | J/mol×K | [1157.89; 1453.05] | 
|
| Cp,gas | 1755.10 | J/mol×K | 1157.89 | Joback Calculated Property |
| Cp,gas | 1776.16 | J/mol×K | 1207.08 | Joback Calculated Property |
| Cp,gas | 1794.88 | J/mol×K | 1256.28 | Joback Calculated Property |
| Cp,gas | 1811.51 | J/mol×K | 1305.47 | Joback Calculated Property |
| Cp,gas | 1826.28 | J/mol×K | 1354.66 | Joback Calculated Property |
| Cp,gas | 1839.44 | J/mol×K | 1403.86 | Joback Calculated Property |
| Cp,gas | 1851.24 | J/mol×K | 1453.05 | Joback Calculated Property |
| η | [0.0000042; 0.0000952] | Pa×s | [643.62; 1157.89] |
|
| η | 0.0000952 | Pa×s | 643.62 | Joback Calculated Property |
| η | 0.0000418 | Pa×s | 729.33 | Joback Calculated Property |
| η | 0.0000218 | Pa×s | 815.04 | Joback Calculated Property |
| η | 0.0000129 | Pa×s | 900.75 | Joback Calculated Property |
| η | 0.0000083 | Pa×s | 986.47 | Joback Calculated Property |
| η | 0.0000058 | Pa×s | 1072.18 | Joback Calculated Property |
| η | 0.0000042 | Pa×s | 1157.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, octadecyl 2,4,4-trimethylpentyl ester.
Sources
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