- InChI
- InChI=1S/C10H13NO/c1-3-11-10(12)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,11,12)
- InChI Key
- QLPRAXXGCFGXLJ-UHFFFAOYSA-N
- Formula
- C10H13NO
- SMILES
- CCNC(=O)c1ccc(C)cc1
- Molecular Weight1
- 163.22
- 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° | 96.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -83.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.97 | kJ/mol | Joback Calculated Property |
| log10WS | -2.71 | Crippen Calculated Property | |
| logPoct/wat | 1.745 | Crippen Calculated Property | |
| McVol | 139.550 | ml/mol | McGowan Calculated Property |
| Pc | 3135.00 | kPa | Joback Calculated Property |
| Inp | [1593.00; 1593.00] |
|
|
| Inp | 1593.00 | NIST | |
| Inp | 1593.00 | NIST | |
| Tboil | 563.90 | K | Joback Calculated Property |
| Tc | 780.09 | K | Joback Calculated Property |
| Tfus | 343.99 | K | Joback Calculated Property |
| Vc | 0.528 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [323.52; 393.26] | J/mol×K | [563.90; 780.09] |
|
| Cp,gas | 323.52 | J/mol×K | 563.90 | Joback Calculated Property |
| Cp,gas | 337.10 | J/mol×K | 599.93 | Joback Calculated Property |
| Cp,gas | 349.85 | J/mol×K | 635.96 | Joback Calculated Property |
| Cp,gas | 361.81 | J/mol×K | 672.00 | Joback Calculated Property |
| Cp,gas | 373.02 | J/mol×K | 708.03 | Joback Calculated Property |
| Cp,gas | 383.49 | J/mol×K | 744.06 | Joback Calculated Property |
| Cp,gas | 393.26 | J/mol×K | 780.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-methyl-N-ethyl-.
Sources
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