- InChI
- InChI=1S/C26H35NO3/c1-4-5-6-7-8-20-30-26(29)11-9-10-25(28)27(23-16-12-21(2)13-17-23)24-18-14-22(3)15-19-24/h12-19H,4-11,20H2,1-3H3
- InChI Key
- CDUCEFZEWYEBGA-UHFFFAOYSA-N
- Formula
- C26H35NO3
- SMILES
-
CCCCCCCOC(=O)CCCC(=O)N(c1ccc(C
)cc1)c1ccc(C)cc1 - Molecular Weight1
- 409.56
- 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 | 1.1089 | Relay (1.0) Calculated Property | |
| ΔfG° | 121.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -572.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.33 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.51 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.652 | Crippen Calculated Property | |
| McVol | 348.670 | ml/mol | McGowan Calculated Property |
| Pc | 1129.86 | kPa | Joback Calculated Property |
| Inp | 3106.00 | NIST | |
| Tboil | 720.33 | K | Relay (1.0) Calculated Property |
| Tc | 970.94 | K | Relay (1.0) Calculated Property |
| Tfus | 355.27 | K | Relay (1.0) Calculated Property |
| Vc | 1.277 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1152.21; 1226.80] | J/mol×K | [1000.20; 1226.65] | 
|
| Cp,gas | 1152.21 | J/mol×K | 1000.20 | Joback Calculated Property |
| Cp,gas | 1167.65 | J/mol×K | 1037.94 | Joback Calculated Property |
| Cp,gas | 1181.77 | J/mol×K | 1075.68 | Joback Calculated Property |
| Cp,gas | 1194.66 | J/mol×K | 1113.42 | Joback Calculated Property |
| Cp,gas | 1206.40 | J/mol×K | 1151.17 | Joback Calculated Property |
| Cp,gas | 1217.09 | J/mol×K | 1188.91 | Joback Calculated Property |
| Cp,gas | 1226.80 | J/mol×K | 1226.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N,N-di(4-methylphenyl)-, heptyl ester.
Sources
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