- InChI
- InChI=1S/C19H26O5/c1-14(2)12-13-22-18(20)10-7-11-19(21)24-17-9-6-5-8-16(17)23-15(3)4/h5-6,8-9,12,15H,7,10-11,13H2,1-4H3
- InChI Key
- JCCGAWBYWKYJDK-UHFFFAOYSA-N
- Formula
- C19H26O5
- SMILES
-
CC(C)=CCOC(=O)CCCC(=O)Oc1ccccc
1OC(C)C - Molecular Weight1
- 334.41
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8559 | Relay (1.0) Calculated Property | |
| ΔfG° | -291.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -868.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.07 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.059 | Crippen Calculated Property | |
| McVol | 271.260 | ml/mol | McGowan Calculated Property |
| Pc | 1495.35 | kPa | Joback Calculated Property |
| Inp | 2332.00 | NIST | |
| Tboil | 627.96 | K | Relay (1.0) Calculated Property |
| Tc | 823.46 | K | Relay (1.0) Calculated Property |
| Tfus | 314.57 | K | Relay (1.0) Calculated Property |
| Vc | 0.993 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [821.80; 896.37] | J/mol×K | [844.38; 1052.85] | 
|
| Cp,gas | 821.80 | J/mol×K | 844.38 | Joback Calculated Property |
| Cp,gas | 837.04 | J/mol×K | 879.12 | Joback Calculated Property |
| Cp,gas | 851.13 | J/mol×K | 913.87 | Joback Calculated Property |
| Cp,gas | 864.09 | J/mol×K | 948.61 | Joback Calculated Property |
| Cp,gas | 875.93 | J/mol×K | 983.36 | Joback Calculated Property |
| Cp,gas | 886.68 | J/mol×K | 1018.10 | Joback Calculated Property |
| Cp,gas | 896.37 | J/mol×K | 1052.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 3-methylbut-2-en-1-yl 2-isopropoxyphenyl ester.
Sources
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