- InChI
- InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-12-18-26-22(25)17-13-16-21(24)23(2)19-20-14-10-9-11-15-20/h9-11,14-15H,3-8,12-13,16-19H2,1-2H3
- InChI Key
- CNEHHHUEYISLOR-UHFFFAOYSA-N
- Formula
- C22H35NO3
- SMILES
-
CCCCCCCCCOC(=O)CCCC(=O)N(C)Cc1
ccccc1 - Molecular Weight1
- 361.52
- 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° | -5.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -550.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.79 | kJ/mol | Joback Calculated Property |
| log10WS | -5.84 | Crippen Calculated Property | |
| logPoct/wat | 5.109 | Crippen Calculated Property | |
| McVol | 316.070 | ml/mol | McGowan Calculated Property |
| Pc | 1195.65 | kPa | Joback Calculated Property |
| Inp | 2845.00 | NIST | |
| Tboil | 872.04 | K | Joback Calculated Property |
| Tc | 1072.75 | K | Joback Calculated Property |
| Tfus | 518.68 | K | Joback Calculated Property |
| Vc | 1.208 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1010.77; 1097.54] | J/mol×K | [872.04; 1072.75] | 
|
| Cp,gas | 1010.77 | J/mol×K | 872.04 | Joback Calculated Property |
| Cp,gas | 1027.93 | J/mol×K | 905.49 | Joback Calculated Property |
| Cp,gas | 1043.94 | J/mol×K | 938.94 | Joback Calculated Property |
| Cp,gas | 1058.86 | J/mol×K | 972.40 | Joback Calculated Property |
| Cp,gas | 1072.72 | J/mol×K | 1005.85 | Joback Calculated Property |
| Cp,gas | 1085.60 | J/mol×K | 1039.30 | Joback Calculated Property |
| Cp,gas | 1097.54 | J/mol×K | 1072.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-methyl-N-benzyl-, nonyl ester.
Sources
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