- InChI
- InChI=1S/C15H15NO/c1-11-6-8-13(9-7-11)15(17)16-14-5-3-4-12(2)10-14/h3-10H,1-2H3,(H,16,17)
- InChI Key
- UUOQMDYIKKMSTR-UHFFFAOYSA-N
- Formula
- C15H15NO
- SMILES
- Cc1ccc(C(=O)Nc2cccc(C)c2)cc1
- Molecular Weight1
- 225.29
- 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° | 241.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 38.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.04 | kJ/mol | Joback Calculated Property |
| log10WS | -4.40 | Crippen Calculated Property | |
| logPoct/wat | 3.556 | Crippen Calculated Property | |
| McVol | 186.240 | ml/mol | McGowan Calculated Property |
| Pc | 2629.85 | kPa | Joback Calculated Property |
| Inp | [2173.00; 2173.00] |
|
|
| Inp | 2173.00 | NIST | |
| Inp | 2173.00 | NIST | |
| Tboil | 709.96 | K | Joback Calculated Property |
| Tc | 950.27 | K | Joback Calculated Property |
| Tfus | 439.28 | K | Joback Calculated Property |
| Vc | 0.701 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [490.89; 564.95] | J/mol×K | [709.96; 950.27] |
|
| Cp,gas | 490.89 | J/mol×K | 709.96 | Joback Calculated Property |
| Cp,gas | 505.97 | J/mol×K | 750.01 | Joback Calculated Property |
| Cp,gas | 519.86 | J/mol×K | 790.06 | Joback Calculated Property |
| Cp,gas | 532.64 | J/mol×K | 830.12 | Joback Calculated Property |
| Cp,gas | 544.37 | J/mol×K | 870.17 | Joback Calculated Property |
| Cp,gas | 555.12 | J/mol×K | 910.22 | Joback Calculated Property |
| Cp,gas | 564.95 | J/mol×K | 950.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-(3-methylphenyl)-4-methyl-.
Sources
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