- InChI
- InChI=1S/C18H26O4/c1-6-12-21-16(19)13-8-10-14(11-9-13)17(20)22-15(7-2)18(3,4)5/h8-11,15H,6-7,12H2,1-5H3
- InChI Key
- GFSUUEIJZZJFQT-UHFFFAOYSA-N
- Formula
- C18H26O4
- SMILES
-
CCCOC(=O)c1ccc(C(=O)OC(CC)C(C)
(C)C)cc1 - Molecular Weight1
- 306.40
- 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° | -263.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -693.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.23 | kJ/mol | Joback Calculated Property |
| log10WS | -5.18 | Crippen Calculated Property | |
| logPoct/wat | 4.235 | Crippen Calculated Property | |
| McVol | 255.600 | ml/mol | McGowan Calculated Property |
| Pc | 1586.01 | kPa | Joback Calculated Property |
| Inp | [2145.00; 2145.00] |
|
|
| Inp | 2145.00 | NIST | |
| Inp | 2145.00 | NIST | |
| Tboil | 791.81 | K | Joback Calculated Property |
| Tc | 1001.25 | K | Joback Calculated Property |
| Tfus | 463.30 | K | Joback Calculated Property |
| Vc | 0.967 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [763.36; 843.81] | J/mol×K | [791.81; 1001.25] |
|
| Cp,gas | 763.36 | J/mol×K | 791.81 | Joback Calculated Property |
| Cp,gas | 779.50 | J/mol×K | 826.72 | Joback Calculated Property |
| Cp,gas | 794.50 | J/mol×K | 861.62 | Joback Calculated Property |
| Cp,gas | 808.40 | J/mol×K | 896.53 | Joback Calculated Property |
| Cp,gas | 821.22 | J/mol×K | 931.44 | Joback Calculated Property |
| Cp,gas | 833.02 | J/mol×K | 966.34 | Joback Calculated Property |
| Cp,gas | 843.81 | J/mol×K | 1001.25 | Joback Calculated Property |
| η | [0.0000533; 0.0007844] | Pa×s | [463.30; 791.81] |
|
| η | 0.0007844 | Pa×s | 463.30 | Joback Calculated Property |
| η | 0.0003954 | Pa×s | 518.05 | Joback Calculated Property |
| η | 0.0002272 | Pa×s | 572.80 | Joback Calculated Property |
| η | 0.0001438 | Pa×s | 627.55 | Joback Calculated Property |
| η | 0.0000980 | Pa×s | 682.31 | Joback Calculated Property |
| η | 0.0000707 | Pa×s | 737.06 | Joback Calculated Property |
| η | 0.0000533 | Pa×s | 791.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Terephthalic acid, 4,4-dimethylpent-2-yl propyl ester.
Sources
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