- InChI
- InChI=1S/C23H37NO3/c1-3-5-7-8-9-13-20-27-23(26)18-14-17-22(25)24(19-6-4-2)21-15-11-10-12-16-21/h10-12,15-16H,3-9,13-14,17-20H2,1-2H3
- InChI Key
- PGKOSLFQBYBWRC-UHFFFAOYSA-N
- Formula
- C23H37NO3
- SMILES
-
CCCCCCCCOC(=O)CCCC(=O)N(CCCC)c
1ccccc1 - Molecular Weight1
- 375.54
- 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 | 1.0648 | Relay (1.0) Calculated Property | |
| ΔfG° | 3.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -693.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.07 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.894 | Crippen Calculated Property | |
| McVol | 330.160 | ml/mol | McGowan Calculated Property |
| Pc | 1120.05 | kPa | Joback Calculated Property |
| Inp | 2731.00 | NIST | |
| Tboil | 668.59 | K | Relay (1.0) Calculated Property |
| Tc | 877.01 | K | Relay (1.0) Calculated Property |
| Tfus | 313.85 | K | Relay (1.0) Calculated Property |
| Vc | 1.228 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1071.71; 1159.60] | J/mol×K | [894.92; 1098.19] | 
|
| Cp,gas | 1071.71 | J/mol×K | 894.92 | Joback Calculated Property |
| Cp,gas | 1089.14 | J/mol×K | 928.80 | Joback Calculated Property |
| Cp,gas | 1105.38 | J/mol×K | 962.68 | Joback Calculated Property |
| Cp,gas | 1120.49 | J/mol×K | 996.55 | Joback Calculated Property |
| Cp,gas | 1134.52 | J/mol×K | 1030.43 | Joback Calculated Property |
| Cp,gas | 1147.54 | J/mol×K | 1064.31 | Joback Calculated Property |
| Cp,gas | 1159.60 | J/mol×K | 1098.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-butyl-N-phenyl-, octyl ester.
Sources
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