- InChI
- InChI=1S/C16H22O4/c1-3-14(13-9-6-5-7-10-13)20-16(18)12-8-11-15(17)19-4-2/h5-7,9-10,14H,3-4,8,11-12H2,1-2H3
- InChI Key
- LNLFMHRTUCNCDH-UHFFFAOYSA-N
- Formula
- C16H22O4
- SMILES
- CCOC(=O)CCCC(=O)OC(CC)c1ccccc1
- Molecular Weight1
- 278.34
- 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° | -274.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -631.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.41 | kJ/mol | Joback Calculated Property |
| log10WS | -3.81 | Crippen Calculated Property | |
| logPoct/wat | 3.414 | Crippen Calculated Property | |
| McVol | 227.420 | ml/mol | McGowan Calculated Property |
| Pc | 1853.11 | kPa | Joback Calculated Property |
| Inp | 1973.00 | NIST | |
| Tboil | 744.30 | K | Joback Calculated Property |
| Tc | 948.22 | K | Joback Calculated Property |
| Tfus | 425.82 | K | Joback Calculated Property |
| Vc | 0.866 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [649.77; 727.58] | J/mol×K | [744.30; 948.22] | 
|
| Cp,gas | 649.77 | J/mol×K | 744.30 | Joback Calculated Property |
| Cp,gas | 665.24 | J/mol×K | 778.29 | Joback Calculated Property |
| Cp,gas | 679.68 | J/mol×K | 812.27 | Joback Calculated Property |
| Cp,gas | 693.12 | J/mol×K | 846.26 | Joback Calculated Property |
| Cp,gas | 705.57 | J/mol×K | 880.25 | Joback Calculated Property |
| Cp,gas | 717.05 | J/mol×K | 914.23 | Joback Calculated Property |
| Cp,gas | 727.58 | J/mol×K | 948.22 | Joback Calculated Property |
| η | [0.0000859; 0.0012005] | Pa×s | [425.82; 744.30] |
|
| η | 0.0012005 | Pa×s | 425.82 | Joback Calculated Property |
| η | 0.0006062 | Pa×s | 478.90 | Joback Calculated Property |
| η | 0.0003509 | Pa×s | 531.98 | Joback Calculated Property |
| η | 0.0002242 | Pa×s | 585.06 | Joback Calculated Property |
| η | 0.0001544 | Pa×s | 638.14 | Joback Calculated Property |
| η | 0.0001126 | Pa×s | 691.22 | Joback Calculated Property |
| η | 0.0000859 | Pa×s | 744.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, ethyl 1-phenylpropyl ester.
Sources
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