- InChI
- InChI=1S/C20H25NO/c1-4-6-9-17-11-13-18(14-12-17)20(22)21(5-2)19-10-7-8-16(3)15-19/h7-8,10-15H,4-6,9H2,1-3H3
- InChI Key
- PGZZJWNPIRTSLL-UHFFFAOYSA-N
- Formula
- C20H25NO
- SMILES
-
CCCCc1ccc(C(=O)N(CC)c2cccc(C)c
2)cc1 - Molecular Weight1
- 295.42
- 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 | 0.7886 | Relay (1.0) Calculated Property | |
| ΔfG° | 304.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -137.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.51 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.004 | Crippen Calculated Property | |
| McVol | 256.690 | ml/mol | McGowan Calculated Property |
| Pc | 1672.79 | kPa | Joback Calculated Property |
| Inp | 2243.00 | NIST | |
| Tboil | 665.91 | K | Relay (1.0) Calculated Property |
| Tc | 902.18 | K | Relay (1.0) Calculated Property |
| Tfus | 319.28 | K | Relay (1.0) Calculated Property |
| Vc | 0.945 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [750.02; 836.99] | J/mol×K | [786.63; 1006.08] | 
|
| Cp,gas | 750.02 | J/mol×K | 786.63 | Joback Calculated Property |
| Cp,gas | 767.30 | J/mol×K | 823.21 | Joback Calculated Property |
| Cp,gas | 783.36 | J/mol×K | 859.78 | Joback Calculated Property |
| Cp,gas | 798.29 | J/mol×K | 896.36 | Joback Calculated Property |
| Cp,gas | 812.15 | J/mol×K | 932.93 | Joback Calculated Property |
| Cp,gas | 825.03 | J/mol×K | 969.51 | Joback Calculated Property |
| Cp,gas | 836.99 | J/mol×K | 1006.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-ethyl-N-(3-methylphenyl)-4-butyl-.
Sources
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