- InChI
- InChI=1S/C17H25NO3/c1-14(2)13-21-17(20)11-7-10-16(19)18(3)12-15-8-5-4-6-9-15/h4-6,8-9,14H,7,10-13H2,1-3H3
- InChI Key
- PPJGPPYNXBYACX-UHFFFAOYSA-N
- Formula
- C17H25NO3
- SMILES
-
CC(C)COC(=O)CCCC(=O)N(C)Cc1ccc
cc1 - Molecular Weight1
- 291.39
- 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° | -49.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -452.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.27 | kJ/mol | Joback Calculated Property |
| log10WS | -3.50 | Crippen Calculated Property | |
| logPoct/wat | 3.014 | Crippen Calculated Property | |
| McVol | 245.620 | ml/mol | McGowan Calculated Property |
| Pc | 1730.34 | kPa | Joback Calculated Property |
| Inp | 2298.00 | NIST | |
| Tboil | 757.20 | K | Joback Calculated Property |
| Tc | 958.71 | K | Joback Calculated Property |
| Tfus | 447.33 | K | Joback Calculated Property |
| Vc | 0.921 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [718.09; 800.23] | J/mol×K | [757.20; 958.71] | 
|
| Cp,gas | 718.09 | J/mol×K | 757.20 | Joback Calculated Property |
| Cp,gas | 734.30 | J/mol×K | 790.78 | Joback Calculated Property |
| Cp,gas | 749.44 | J/mol×K | 824.37 | Joback Calculated Property |
| Cp,gas | 763.57 | J/mol×K | 857.95 | Joback Calculated Property |
| Cp,gas | 776.71 | J/mol×K | 891.54 | Joback Calculated Property |
| Cp,gas | 788.92 | J/mol×K | 925.12 | Joback Calculated Property |
| Cp,gas | 800.23 | J/mol×K | 958.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-methyl-N-benzyl-, isobutyl ester.
Sources
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