- InChI
- InChI=1S/C13H19N/c1-3-7-13(8-4-1)9-12-14-10-5-2-6-11-14/h1,3-4,7-8H,2,5-6,9-12H2
- InChI Key
- DBDVAKGHPZJLTH-UHFFFAOYSA-N
- Formula
- C13H19N
- SMILES
- c1ccc(CCN2CCCCC2)cc1
- Molecular Weight1
- 189.30
- CAS
- 332-14-9
- Other Names
-
- 1-Phenethylpiperidine
- Piperidine, 1-phenethyl-
- FMP-199
- 1-Piperidino-2-phenyl-aethan
- 1-Piperidino-2-phenylethane
- 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 | 0.4376 | Relay (1.0) Calculated Property | |
| ΔfG° | 263.83 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 72.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 69.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.715 | Crippen Calculated Property | |
| McVol | 169.390 | ml/mol | McGowan Calculated Property |
| Pc | 2397.21 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 545.20 | K | NIST |
| Tc | 770.34 | K | Relay (1.0) Calculated Property |
| Tfus | 278.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.615 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Piperidine, 1-(2-phenylethyl)-.
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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