- InChI
- InChI=1S/C19H26O4/c1-3-5-7-9-14-23-19(21)17-12-10-11-16(15-17)18(20)22-13-8-6-4-2/h4,10-12,15H,2-3,5-9,13-14H2,1H3
- InChI Key
- OLEAGAUWVXSJDI-UHFFFAOYSA-N
- Formula
- C19H26O4
- SMILES
-
C=CCCCOC(=O)c1cccc(C(=O)OCCCCC
C)c1 - Molecular Weight1
- 318.41
- 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° | -168.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -574.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.47 | kJ/mol | Joback Calculated Property |
| log10WS | -5.58 | Crippen Calculated Property | |
| logPoct/wat | 4.547 | Crippen Calculated Property | |
| McVol | 265.390 | ml/mol | McGowan Calculated Property |
| Pc | 1488.44 | kPa | Joback Calculated Property |
| Inp | [2347.00; 2347.00] |
|
|
| Inp | 2347.00 | NIST | |
| Inp | 2347.00 | NIST | |
| Tboil | 815.04 | K | Joback Calculated Property |
| Tc | 1016.36 | K | Joback Calculated Property |
| Tfus | 485.39 | K | Joback Calculated Property |
| Vc | 1.020 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [792.31; 869.46] | J/mol×K | [815.04; 1016.36] |
|
| Cp,gas | 792.31 | J/mol×K | 815.04 | Joback Calculated Property |
| Cp,gas | 807.73 | J/mol×K | 848.59 | Joback Calculated Property |
| Cp,gas | 822.10 | J/mol×K | 882.15 | Joback Calculated Property |
| Cp,gas | 835.43 | J/mol×K | 915.70 | Joback Calculated Property |
| Cp,gas | 847.75 | J/mol×K | 949.25 | Joback Calculated Property |
| Cp,gas | 859.08 | J/mol×K | 982.80 | Joback Calculated Property |
| Cp,gas | 869.46 | J/mol×K | 1016.36 | Joback Calculated Property |
| η | [0.0000671; 0.0006656] | Pa×s | [485.39; 815.04] |
|
| η | 0.0006656 | Pa×s | 485.39 | Joback Calculated Property |
| η | 0.0003739 | Pa×s | 540.33 | Joback Calculated Property |
| η | 0.0002336 | Pa×s | 595.27 | Joback Calculated Property |
| η | 0.0001580 | Pa×s | 650.21 | Joback Calculated Property |
| η | 0.0001136 | Pa×s | 705.16 | Joback Calculated Property |
| η | 0.0000857 | Pa×s | 760.10 | Joback Calculated Property |
| η | 0.0000671 | Pa×s | 815.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, hexyl pent-4-enyl ester.
Sources
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