- InChI
- InChI=1S/C12H16N2O/c15-12(14-9-5-2-6-10-14)13-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,13,15)
- InChI Key
- UICIJOHWFFTRLI-UHFFFAOYSA-N
- Formula
- C12H16N2O
- SMILES
- OC(=Nc1ccccc1)N1CCCCC1
- Molecular Weight1
- 204.27
- CAS
- 2645-36-5
- Other Names
-
- Piperidyl formanilide
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.7159 | Relay (1.0) Calculated Property | |
| ΔfG° | 244.02 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -113.08 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 101.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.25 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.718 | Crippen Calculated Property | |
| McVol | 166.850 | ml/mol | McGowan Calculated Property |
| Pc | 3626.66 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 608.67 | K | Relay (1.0) Calculated Property |
| Tc | 864.14 | K | Relay (1.0) Calculated Property |
| Tfus | 409.43 | K | Relay (1.0) Calculated Property |
| Vc | 0.582 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 1-Piperidinecarboxamide, N-phenyl-.
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
- McGowan Method
- NIST Webbook
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