- InChI
- InChI=1S/C18H24O4/c1-3-5-7-8-14-22-18(20)16-11-9-15(10-12-16)17(19)21-13-6-4-2/h4,9-12H,2-3,5-8,13-14H2,1H3
- InChI Key
- GOCUZZWHKYALTN-UHFFFAOYSA-N
- Formula
- C18H24O4
- SMILES
-
C=CCCOC(=O)c1ccc(C(=O)OCCCCCC)
cc1 - Molecular Weight1
- 304.38
- 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° | -176.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -553.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.24 | kJ/mol | Joback Calculated Property |
| log10WS | -5.16 | Crippen Calculated Property | |
| logPoct/wat | 4.157 | Crippen Calculated Property | |
| McVol | 251.300 | ml/mol | McGowan Calculated Property |
| Pc | 1605.13 | kPa | Joback Calculated Property |
| Inp | [2328.00; 2328.00] |
|
|
| Inp | 2328.00 | NIST | |
| Inp | 2328.00 | NIST | |
| Tboil | 792.16 | K | Joback Calculated Property |
| Tc | 993.99 | K | Joback Calculated Property |
| Tfus | 474.12 | K | Joback Calculated Property |
| Vc | 0.965 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [735.06; 811.19] | J/mol×K | [792.16; 993.99] |
|
| Cp,gas | 735.06 | J/mol×K | 792.16 | Joback Calculated Property |
| Cp,gas | 750.23 | J/mol×K | 825.80 | Joback Calculated Property |
| Cp,gas | 764.38 | J/mol×K | 859.44 | Joback Calculated Property |
| Cp,gas | 777.53 | J/mol×K | 893.07 | Joback Calculated Property |
| Cp,gas | 789.70 | J/mol×K | 926.71 | Joback Calculated Property |
| Cp,gas | 800.91 | J/mol×K | 960.35 | Joback Calculated Property |
| Cp,gas | 811.19 | J/mol×K | 993.99 | Joback Calculated Property |
| η | [0.0000767; 0.0007284] | Pa×s | [474.12; 792.16] |
|
| η | 0.0007284 | Pa×s | 474.12 | Joback Calculated Property |
| η | 0.0004144 | Pa×s | 527.13 | Joback Calculated Property |
| η | 0.0002614 | Pa×s | 580.13 | Joback Calculated Property |
| η | 0.0001781 | Pa×s | 633.14 | Joback Calculated Property |
| η | 0.0001288 | Pa×s | 686.15 | Joback Calculated Property |
| η | 0.0000975 | Pa×s | 739.15 | Joback Calculated Property |
| η | 0.0000767 | Pa×s | 792.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Terephthalic acid, but-3-enyl hexyl ester.
Sources
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