- InChI
- InChI=1S/C18H21NO/c1-4-15-9-11-16(12-10-15)18(20)19(5-2)17-8-6-7-14(3)13-17/h6-13H,4-5H2,1-3H3
- InChI Key
- QAZLOYMALKJQLM-UHFFFAOYSA-N
- Formula
- C18H21NO
- SMILES
-
CCc1ccc(C(=O)N(CC)c2cccc(C)c2)
cc1 - Molecular Weight1
- 267.37
- 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 | 0.7055 | Relay (1.0) Calculated Property | |
| ΔfG° | 288.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -91.86 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.224 | Crippen Calculated Property | |
| McVol | 228.510 | ml/mol | McGowan Calculated Property |
| Pc | 1970.05 | kPa | Joback Calculated Property |
| Inp | 2050.00 | NIST | |
| Tboil | 645.12 | K | Relay (1.0) Calculated Property |
| Tc | 892.92 | K | Relay (1.0) Calculated Property |
| Tfus | 317.01 | K | Relay (1.0) Calculated Property |
| Vc | 0.840 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [637.77; 722.50] | J/mol×K | [741.07; 967.06] | 
|
| Cp,gas | 637.77 | J/mol×K | 741.07 | Joback Calculated Property |
| Cp,gas | 654.72 | J/mol×K | 778.73 | Joback Calculated Property |
| Cp,gas | 670.44 | J/mol×K | 816.40 | Joback Calculated Property |
| Cp,gas | 685.01 | J/mol×K | 854.06 | Joback Calculated Property |
| Cp,gas | 698.49 | J/mol×K | 891.73 | Joback Calculated Property |
| Cp,gas | 710.96 | J/mol×K | 929.39 | Joback Calculated Property |
| Cp,gas | 722.50 | J/mol×K | 967.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-ethyl-N-(3-methylphenyl)-4-ethyl-.
Sources
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