- InChI
- InChI=1S/C19H26O4/c1-2-3-7-15-22-18(20)13-8-14-19(21)23-16-9-12-17-10-5-4-6-11-17/h4-6,9-12H,2-3,7-8,13-16H2,1H3/b12-9+
- InChI Key
- WAEPAEDHIPTSMS-FMIVXFBMSA-N
- Formula
- C19H26O4
- SMILES
-
CCCCCOC(=O)CCCC(=O)OCC=Cc1cccc
c1 - Molecular Weight1
- 318.41
- ω : Acentric Factor.
- 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).
- 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 | 0.8491 | Relay (1.0) Calculated Property | |
| ΔfG° | -166.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -696.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 44.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.25 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.47 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.147 | Crippen Calculated Property | |
| McVol | 265.390 | ml/mol | McGowan Calculated Property |
| Pc | 1517.57 | kPa | Joback Calculated Property |
| Inp | [2515.00; 2515.00] |
|
|
| Inp | 2515.00 | NIST | |
| Inp | 2515.00 | NIST | |
| Tboil | 642.86 | K | Relay (1.0) Calculated Property |
| Tc | 826.93 | K | Relay (1.0) Calculated Property |
| Tfus | 296.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.964 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [793.84; 871.95] | J/mol×K | [817.54; 1020.90] |
|
| Cp,gas | 793.84 | J/mol×K | 817.54 | Joback Calculated Property |
| Cp,gas | 809.36 | J/mol×K | 851.43 | Joback Calculated Property |
| Cp,gas | 823.82 | J/mol×K | 885.33 | Joback Calculated Property |
| Cp,gas | 837.28 | J/mol×K | 919.22 | Joback Calculated Property |
| Cp,gas | 849.76 | J/mol×K | 953.11 | Joback Calculated Property |
| Cp,gas | 861.30 | J/mol×K | 987.01 | Joback Calculated Property |
| Cp,gas | 871.95 | J/mol×K | 1020.90 | Joback Calculated Property |
| η | [0.0000542; 0.0007150] | Pa×s | [469.55; 817.54] |
|
| η | 0.0007150 | Pa×s | 469.55 | Joback Calculated Property |
| η | 0.0003673 | Pa×s | 527.55 | Joback Calculated Property |
| η | 0.0002152 | Pa×s | 585.55 | Joback Calculated Property |
| η | 0.0001389 | Pa×s | 643.54 | Joback Calculated Property |
| η | 0.0000964 | Pa×s | 701.54 | Joback Calculated Property |
| η | 0.0000707 | Pa×s | 759.54 | Joback Calculated Property |
| η | 0.0000542 | Pa×s | 817.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, pentyl 3-phenylprop-2-enyl ester.
Sources
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