- InChI
- InChI=1S/C25H43NO/c1-5-9-14-22(7-3)20-26(21-23(8-4)15-10-6-2)25(27)19-18-24-16-12-11-13-17-24/h11-13,16-17,22-23H,5-10,14-15,18-21H2,1-4H3
- InChI Key
- FHIAPOALXTYFEJ-UHFFFAOYSA-N
- Formula
- C25H43NO
- SMILES
-
CCCCC(CC)CN(CC(CC)CCCC)C(=O)CC
c1ccccc1 - Molecular Weight1
- 373.62
- 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 | 0.9188 | Relay (1.0) Calculated Property | |
| ΔfG° | 249.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -451.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 52.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 103.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.881 | Crippen Calculated Property | |
| McVol | 350.900 | ml/mol | McGowan Calculated Property |
| Pc | 970.49 | kPa | Joback Calculated Property |
| Inp | [2534.00; 2534.00] |
|
|
| Inp | 2534.00 | NIST | |
| Inp | 2534.00 | NIST | |
| Tboil | 659.51 | K | Relay (1.0) Calculated Property |
| Tc | 868.54 | K | Relay (1.0) Calculated Property |
| Tfus | 260.75 | K | Relay (1.0) Calculated Property |
| Vc | 1.268 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1142.60; 1247.11] | J/mol×K | [863.51; 1061.30] |
|
| Cp,gas | 1142.60 | J/mol×K | 863.51 | Joback Calculated Property |
| Cp,gas | 1162.80 | J/mol×K | 896.47 | Joback Calculated Property |
| Cp,gas | 1181.78 | J/mol×K | 929.44 | Joback Calculated Property |
| Cp,gas | 1199.63 | J/mol×K | 962.40 | Joback Calculated Property |
| Cp,gas | 1216.42 | J/mol×K | 995.37 | Joback Calculated Property |
| Cp,gas | 1232.22 | J/mol×K | 1028.33 | Joback Calculated Property |
| Cp,gas | 1247.11 | J/mol×K | 1061.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-bis(2-ethylhexyl)-3-phenyl-.
Sources
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