- InChI
- InChI=1S/C17H22O5/c1-3-4-12-21-16(19)6-5-7-17(20)22-15-10-8-14(9-11-15)13(2)18/h8-11H,3-7,12H2,1-2H3
- InChI Key
- ZMAZUQXWYNZFNZ-UHFFFAOYSA-N
- Formula
- C17H22O5
- SMILES
-
CCCCOC(=O)CCCC(=O)Oc1ccc(C(C)=
O)cc1 - Molecular Weight1
- 306.35
- 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° | -401.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -771.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.43 | kJ/mol | Joback Calculated Property |
| log10WS | -4.24 | Crippen Calculated Property | |
| logPoct/wat | 3.308 | Crippen Calculated Property | |
| McVol | 243.080 | ml/mol | McGowan Calculated Property |
| Pc | 1766.90 | kPa | Joback Calculated Property |
| Inp | [2456.00; 2456.00] |
|
|
| Inp | 2456.00 | NIST | |
| Inp | 2456.00 | NIST | |
| Tboil | 826.47 | K | Joback Calculated Property |
| Tc | 1033.85 | K | Joback Calculated Property |
| Tfus | 514.54 | K | Joback Calculated Property |
| Vc | 0.933 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [720.60; 787.21] | J/mol×K | [826.47; 1033.85] |
|
| Cp,gas | 720.60 | J/mol×K | 826.47 | Joback Calculated Property |
| Cp,gas | 734.32 | J/mol×K | 861.03 | Joback Calculated Property |
| Cp,gas | 746.97 | J/mol×K | 895.60 | Joback Calculated Property |
| Cp,gas | 758.57 | J/mol×K | 930.16 | Joback Calculated Property |
| Cp,gas | 769.14 | J/mol×K | 964.72 | Joback Calculated Property |
| Cp,gas | 778.68 | J/mol×K | 999.29 | Joback Calculated Property |
| Cp,gas | 787.21 | J/mol×K | 1033.85 | Joback Calculated Property |
| η | [0.0000799; 0.0006584] | Pa×s | [514.54; 826.47] |
|
| η | 0.0006584 | Pa×s | 514.54 | Joback Calculated Property |
| η | 0.0003942 | Pa×s | 566.53 | Joback Calculated Property |
| η | 0.0002573 | Pa×s | 618.52 | Joback Calculated Property |
| η | 0.0001794 | Pa×s | 670.50 | Joback Calculated Property |
| η | 0.0001318 | Pa×s | 722.49 | Joback Calculated Property |
| η | 0.0001009 | Pa×s | 774.48 | Joback Calculated Property |
| η | 0.0000799 | Pa×s | 826.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 4-acetylphenyl butyl ester.
Sources
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