- InChI
- InChI=1S/C11H15N3O2/c15-14(16)10-6-7-11(12-8-10)13-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,12,13)
- InChI Key
- OGOQAAXBFKYJBE-UHFFFAOYSA-N
- Formula
- C11H15N3O2
- SMILES
-
O=[N+]([O-])c1ccc(NC2CCCCC2)nc
1 - Molecular Weight1
- 221.26
- CAS
- 25948-14-5
- Other Names
-
- Pyridine, 2-(cyclohexylamino)-5-nitro-
- 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 | 0.6150 | Relay (1.0) Calculated Property | |
| ΔfG° | 326.79 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 15.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 91.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.734 | Crippen Calculated Property | |
| McVol | 168.610 | ml/mol | McGowan Calculated Property |
| Pc | 3268.49 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 609.10 | K | Relay (1.0) Calculated Property |
| Tc | 902.85 | K | Relay (1.0) Calculated Property |
| Tfus | 397.58 | K | Relay (1.0) Calculated Property |
| Vc | 0.580 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Cyclohexylamino-5-nitropyridine.
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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