- InChI
- InChI=1S/C26H43NO3/c1-3-4-5-6-7-8-9-10-11-12-16-22-30-26(29)21-17-20-25(28)27-23(2)24-18-14-13-15-19-24/h13-15,18-19,23H,3-12,16-17,20-22H2,1-2H3,(H,27,28)
- InChI Key
- JXOAJSHHOYKVQS-UHFFFAOYSA-N
- Formula
- C26H43NO3
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCCC(=O)NC(
C)c1ccccc1 - Molecular Weight1
- 417.62
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1358 | Relay (1.0) Calculated Property | |
| ΔfG° | 4.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -798.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 63.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 132.68 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.16 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.888 | Crippen Calculated Property | |
| McVol | 372.430 | ml/mol | McGowan Calculated Property |
| Pc | 945.00 | kPa | Joback Calculated Property |
| Inp | 3236.00 | NIST | |
| Tboil | 673.15 | K | Relay (1.0) Calculated Property |
| Tc | 909.19 | K | Relay (1.0) Calculated Property |
| Tfus | 340.74 | K | Relay (1.0) Calculated Property |
| Vc | 1.381 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1276.55; 1362.18] | J/mol×K | [1000.85; 1226.13] | 
|
| Cp,gas | 1276.55 | J/mol×K | 1000.85 | Joback Calculated Property |
| Cp,gas | 1294.16 | J/mol×K | 1038.40 | Joback Calculated Property |
| Cp,gas | 1310.32 | J/mol×K | 1075.94 | Joback Calculated Property |
| Cp,gas | 1325.12 | J/mol×K | 1113.49 | Joback Calculated Property |
| Cp,gas | 1338.65 | J/mol×K | 1151.04 | Joback Calculated Property |
| Cp,gas | 1350.97 | J/mol×K | 1188.58 | Joback Calculated Property |
| Cp,gas | 1362.18 | J/mol×K | 1226.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-(1-phenylethyl)-, tridecyl ester.
Sources
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