- InChI
- InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3
- InChI Key
- NDNUANOUGZGEPO-UHFFFAOYSA-N
- Formula
- C8H17N
- SMILES
- CCCC1CCCCN1
- Molecular Weight1
- 127.23
- CAS
- 458-88-8
- Other Names
-
- (+)-Coniine
- (S)-(+)-Coniine
- (S)-2-Propylpiperidine
- (S)-Coniine
- 2-Propylpiperidine
- Cicutin
- Cicutine
- Conicine
- Coniin
- Coniine
- Koniin
- Piperidine, 2-propyl-, (2S)-
- d-Conicine
- 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° | 128.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -116.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.59 | kJ/mol | Joback Calculated Property |
| log10WS | -1.50 | Aq. Sol... | |
| logPoct/wat | 1.929 | Crippen Calculated Property | |
| McVol | 122.700 | ml/mol | McGowan Calculated Property |
| Pc | 3243.03 | kPa | Joback Calculated Property |
| Inp | [992.00; 992.00] |
|
|
| Inp | 992.00 | NIST | |
| Inp | 992.00 | NIST | |
| Tboil | 450.54 | K | Joback Calculated Property |
| Tc | 659.37 | K | Joback Calculated Property |
| Tfus | 292.33 | K | Joback Calculated Property |
| Vc | 0.454 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.94; 351.91] | J/mol×K | [450.54; 659.37] |
|
| Cp,gas | 257.94 | J/mol×K | 450.54 | Joback Calculated Property |
| Cp,gas | 275.63 | J/mol×K | 485.34 | Joback Calculated Property |
| Cp,gas | 292.49 | J/mol×K | 520.15 | Joback Calculated Property |
| Cp,gas | 308.53 | J/mol×K | 554.95 | Joback Calculated Property |
| Cp,gas | 323.77 | J/mol×K | 589.76 | Joback Calculated Property |
| Cp,gas | 338.23 | J/mol×K | 624.56 | Joback Calculated Property |
| Cp,gas | 351.91 | J/mol×K | 659.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Piperidine, 2-propyl-, (S)-.
Sources
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