- InChI
- InChI=1S/C18H15NO2/c1-21-15-9-4-8-14(12-15)18(20)19-17-11-5-7-13-6-2-3-10-16(13)17/h2-12H,1H3,(H,19,20)
- InChI Key
- OHBKVALAKGKLJH-UHFFFAOYSA-N
- Formula
- C18H15NO2
- SMILES
-
COc1cccc(C(=O)Nc2cccc3ccccc23)
c1 - Molecular Weight1
- 277.32
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -49.41 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.60 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.101 | Crippen Calculated Property | |
| McVol | 214.920 | ml/mol | McGowan Calculated Property |
| Inp | 2739.00 | NIST | |
| Tboil | 698.23 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [606.83; 673.55] | J/mol×K | [820.00; 1068.62] | 
|
| Cp,gas | 606.83 | J/mol×K | 820.00 | Joback Calculated Property |
| Cp,gas | 620.53 | J/mol×K | 861.44 | Joback Calculated Property |
| Cp,gas | 633.08 | J/mol×K | 902.87 | Joback Calculated Property |
| Cp,gas | 644.55 | J/mol×K | 944.31 | Joback Calculated Property |
| Cp,gas | 655.05 | J/mol×K | 985.75 | Joback Calculated Property |
| Cp,gas | 664.69 | J/mol×K | 1027.18 | Joback Calculated Property |
| Cp,gas | 673.55 | J/mol×K | 1068.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-(1-naphthyl)-3-methoxy-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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