- InChI
- InChI=1S/C8H11N/c1-2-5-8-6-3-4-7-9-8/h3-4,6-7H,2,5H2,1H3
- InChI Key
- OIALIKXMLIAOSN-UHFFFAOYSA-N
- Formula
- C8H11N
- SMILES
- CCCc1ccccn1
- Molecular Weight1
- 121.18
- CAS
- 622-39-9
- Other Names
-
- 1-(2-Pyridyl)propane
- 2-(C3H7)-pyridine
- 2-Propylpyridine
- 2-n-Propylpyridine
- Conyrin
- Conyrine
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 955.70 | kJ/mol | NIST |
| BasG | 923.80 | kJ/mol | NIST |
| log10WS | -2.46 | Crippen Calculated Property | |
| logPoct/wat | 2.034 | Crippen Calculated Property | |
| McVol | 109.800 | ml/mol | McGowan Calculated Property |
| Inp | [960.00; 1013.00] |
|
|
| Inp | 976.50 | NIST | |
| Inp | 976.50 | NIST | |
| Inp | 977.00 | NIST | |
| Inp | 998.00 | NIST | |
| Inp | 1005.00 | NIST | |
| Inp | 1013.00 | NIST | |
| Inp | 980.00 | NIST | |
| Inp | 960.00 | NIST | |
| Inp | 961.00 | NIST | |
| Inp | 976.50 | NIST | |
| Inp | 1013.00 | NIST | |
| I | [1364.00; 1369.00] |
|
|
| I | 1367.00 | NIST | |
| I | 1369.00 | NIST | |
| I | 1364.00 | NIST | |
| I | 1367.00 | NIST | |
| Tboil | 443.20 | K | NIST |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | 46.60 | kJ/mol | 391.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [327.12; 471.99] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.44531e+01 | |||
| Coefficient B | -3.73414e+03 | |||
| Coefficient C | -6.35120e+01 | |||
| Temperature range, min. | 327.12 | |||
| Temperature range, max. | 471.99 | |||
| Pvap | 1.33 | kPa | 327.12 | Calculated Property |
| Pvap | 3.01 | kPa | 343.22 | Calculated Property |
| Pvap | 6.23 | kPa | 359.31 | Calculated Property |
| Pvap | 11.95 | kPa | 375.41 | Calculated Property |
| Pvap | 21.51 | kPa | 391.51 | Calculated Property |
| Pvap | 36.63 | kPa | 407.60 | Calculated Property |
| Pvap | 59.49 | kPa | 423.70 | Calculated Property |
| Pvap | 92.70 | kPa | 439.80 | Calculated Property |
| Pvap | 139.28 | kPa | 455.89 | Calculated Property |
| Pvap | 202.65 | kPa | 471.99 | Calculated Property |
Similar Compounds
Find more compounds similar to Pyridine, 2-propyl-.
Sources
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