- InChI
- InChI=1S/C10H19NO2/c1-2-13-10(12)6-9-11-7-4-3-5-8-11/h2-9H2,1H3
- InChI Key
- MPAWVDTVWPPKJQ-UHFFFAOYSA-N
- Formula
- C10H19NO2
- SMILES
- CCOC(=O)CCN1CCCCC1
- Molecular Weight1
- 185.26
- CAS
- 19653-33-9
- Other Names
-
- Ethyl 1-piperidinepropionate
- «beta»-(N-Piperidino)-propionic acid ethyl ester
- 1-Piperidinepropionic acid, ethyl ester
- ethyl piperidine-1-propionate
- 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 | 0.5215 | Relay (... Calculated Property | |
| ΔfG° | -141.75 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -475.02 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 64.57 | kJ/mol | Relay (... Calculated Property |
| IE | 8.50 | eV | Relay (... Calculated Property |
| log10WS | -0.15 | Relay (... Calculated Property | |
| logPoct/wat | 1.425 | Crippen Calculated Property | |
| McVol | 158.320 | ml/mol | McGowan Calculated Property |
| Pc | 2304.78 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 491.20 | K | NIST |
| Tc | 703.67 | K | Relay (... Calculated Property |
| Tfus | 266.14 | K | Relay (... Calculated Property |
| Vc | 0.575 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 1-Piperidinepropanoic acid, ethyl ester.
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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