- InChI
- InChI=1S/C22H27NO3/c1-2-3-9-17-26-22(25)16-10-15-21(24)23-20-14-8-7-13-19(20)18-11-5-4-6-12-18/h4-8,11-14H,2-3,9-10,15-17H2,1H3,(H,23,24)
- InChI Key
- JKASWCKXAHXLHR-UHFFFAOYSA-N
- Formula
- C22H27NO3
- SMILES
-
CCCCCOC(=O)CCCC(=O)Nc1ccccc1-c
1ccccc1 - Molecular Weight1
- 353.45
- 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).
- 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° | 76.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -339.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.12 | kJ/mol | Joback Calculated Property |
| log10WS | -6.49 | Crippen Calculated Property | |
| logPoct/wat | 5.196 | Crippen Calculated Property | |
| McVol | 292.310 | ml/mol | McGowan Calculated Property |
| Pc | 1524.69 | kPa | Joback Calculated Property |
| Inp | 2866.00 | NIST | |
| Tboil | 941.43 | K | Joback Calculated Property |
| Tc | 1166.03 | K | Joback Calculated Property |
| Tfus | 577.81 | K | Joback Calculated Property |
| Vc | 1.117 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [926.29; 993.26] | J/mol×K | [941.43; 1166.03] | 
|
| Cp,gas | 926.29 | J/mol×K | 941.43 | Joback Calculated Property |
| Cp,gas | 940.30 | J/mol×K | 978.86 | Joback Calculated Property |
| Cp,gas | 953.09 | J/mol×K | 1016.30 | Joback Calculated Property |
| Cp,gas | 964.71 | J/mol×K | 1053.73 | Joback Calculated Property |
| Cp,gas | 975.23 | J/mol×K | 1091.17 | Joback Calculated Property |
| Cp,gas | 984.73 | J/mol×K | 1128.60 | Joback Calculated Property |
| Cp,gas | 993.26 | J/mol×K | 1166.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-(2-biphenyl)-, pentyl ester.
Sources
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