- InChI
- InChI=1S/C13H12N2O/c14-11-6-4-5-10(9-11)13(16)15-12-7-2-1-3-8-12/h1-9H,14H2,(H,15,16)
- InChI Key
- KPSPULPPMWHXGE-UHFFFAOYSA-N
- Formula
- C13H12N2O
- SMILES
- Nc1cccc(C(=O)Nc2ccccc2)c1
- Molecular Weight1
- 212.25
- CAS
- 16091-26-2
- Other Names
-
- 3'-Aminobenzanilide
- 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).
- 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 | 0.6781 | Relay (... Calculated Property | |
| ΔfG° | 300.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 21.79 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 29.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.27 | kJ/mol | Relay (... Calculated Property |
| IE | 7.64 | eV | Relay (... Calculated Property |
| log10WS | -3.31 | Relay (... Calculated Property | |
| logPoct/wat | 2.521 | Crippen Calculated Property | |
| McVol | 168.040 | ml/mol | McGowan Calculated Property |
| Pc | 3517.91 | kPa | Joback Calculated Property |
| Tboil | 642.94 | K | Relay (... Calculated Property |
| Tc | 970.76 | K | Relay (... Calculated Property |
| Tfus | 421.05 | K | Relay (... Calculated Property |
| Vc | 0.599 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [446.89; 509.43] | J/mol×K | [731.75; 986.54] | 
|
| Cp,gas | 446.89 | J/mol×K | 731.75 | Joback Calculated Property |
| Cp,gas | 460.00 | J/mol×K | 774.22 | Joback Calculated Property |
| Cp,gas | 471.92 | J/mol×K | 816.68 | Joback Calculated Property |
| Cp,gas | 482.75 | J/mol×K | 859.15 | Joback Calculated Property |
| Cp,gas | 492.55 | J/mol×K | 901.61 | Joback Calculated Property |
| Cp,gas | 501.41 | J/mol×K | 944.08 | Joback Calculated Property |
| Cp,gas | 509.43 | J/mol×K | 986.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to m-Aminobenzanilide.
Sources
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