- InChI
- InChI=1S/C18H21NO2/c1-3-4-5-14-6-8-15(9-7-14)18(20)19-16-10-12-17(21-2)13-11-16/h6-13H,3-5H2,1-2H3,(H,19,20)
- InChI Key
- DMPZYHAVRAVWJR-UHFFFAOYSA-N
- Formula
- C18H21NO2
- SMILES
-
CCCCc1ccc(C(=O)Nc2ccc(OC)cc2)c
c1 - Molecular Weight1
- 283.36
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 161.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -156.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.13 | kJ/mol | Joback Calculated Property |
| log10WS | -5.21 | Crippen Calculated Property | |
| logPoct/wat | 4.290 | Crippen Calculated Property | |
| McVol | 234.380 | ml/mol | McGowan Calculated Property |
| Pc | 1966.56 | kPa | Joback Calculated Property |
| Inp | 2676.00 | NIST | |
| Tboil | 801.02 | K | Joback Calculated Property |
| Tc | 1026.27 | K | Joback Calculated Property |
| Tfus | 495.32 | K | Joback Calculated Property |
| Vc | 0.886 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [680.59; 756.08] | J/mol×K | [801.02; 1026.27] | 
|
| Cp,gas | 680.59 | J/mol×K | 801.02 | Joback Calculated Property |
| Cp,gas | 696.00 | J/mol×K | 838.56 | Joback Calculated Property |
| Cp,gas | 710.21 | J/mol×K | 876.10 | Joback Calculated Property |
| Cp,gas | 723.27 | J/mol×K | 913.64 | Joback Calculated Property |
| Cp,gas | 735.24 | J/mol×K | 951.19 | Joback Calculated Property |
| Cp,gas | 746.16 | J/mol×K | 988.73 | Joback Calculated Property |
| Cp,gas | 756.08 | J/mol×K | 1026.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-(4-methoxyphenyl)-4-butyl-.
Sources
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