- InChI
- InChI=1S/C18H15NO/c1-13-9-11-15(12-10-13)18(20)19-17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H,19,20)
- InChI Key
- URUKLNMVYAVDAS-UHFFFAOYSA-N
- Formula
- C18H15NO
- SMILES
-
Cc1ccc(C(=O)Nc2cccc3ccccc23)cc
1 - Molecular Weight1
- 261.32
- 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 | 0.6782 | Relay (1.0) Calculated Property | |
| ΔfG° | 373.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 48.35 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.401 | Crippen Calculated Property | |
| McVol | 209.050 | ml/mol | McGowan Calculated Property |
| Pc | 2517.59 | kPa | Joback Calculated Property |
| Inp | [2630.00; 2630.00] |
|
|
| Inp | 2630.00 | NIST | |
| Inp | 2630.00 | NIST | |
| Tboil | 688.52 | K | Relay (1.0) Calculated Property |
| Tc | 1021.88 | K | Relay (1.0) Calculated Property |
| Tfus | 436.60 | K | Relay (1.0) Calculated Property |
| Vc | 0.759 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [580.99; 651.58] | J/mol×K | [797.58; 1050.01] |
|
| Cp,gas | 580.99 | J/mol×K | 797.58 | Joback Calculated Property |
| Cp,gas | 595.23 | J/mol×K | 839.65 | Joback Calculated Property |
| Cp,gas | 608.31 | J/mol×K | 881.72 | Joback Calculated Property |
| Cp,gas | 620.36 | J/mol×K | 923.80 | Joback Calculated Property |
| Cp,gas | 631.50 | J/mol×K | 965.87 | Joback Calculated Property |
| Cp,gas | 641.86 | J/mol×K | 1007.94 | Joback Calculated Property |
| Cp,gas | 651.58 | J/mol×K | 1050.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-(1-naphthyl)-4-methyl-.
Sources
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