- InChI
- InChI=1S/C11H12N4O2/c1-9-13-8-11(15(16)17)14(9)7-4-10-2-5-12-6-3-10/h2-3,5-6,8H,4,7H2,1H3
- InChI Key
- ARYPMCPJIWUCIP-UHFFFAOYSA-N
- Formula
- C11H12N4O2
- SMILES
-
Cc1ncc([N+](=O)[O-])n1CCc1ccnc
c1 - Molecular Weight1
- 232.24
- CAS
- 13752-33-5
- 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).
- 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 |
|---|---|---|---|
| ω | 0.6823 | Relay (... Calculated Property | |
| ΔfG° | 427.43 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 230.72 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 95.77 | kJ/mol | Relay (... Calculated Property |
| IE | 9.17 | eV | Relay (... Calculated Property |
| log10WS | -2.63 | Relay (... Calculated Property | |
| logPoct/wat | 1.737 | Crippen Calculated Property | |
| McVol | 169.990 | ml/mol | McGowan Calculated Property |
| Pc | 3064.95 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2065.00; 2065.00] |
|
|
| Inp | 2065.00 | NIST | |
| Inp | 2065.00 | NIST | |
| Tboil | 613.18 | K | Relay (... Calculated Property |
| Tc | 919.70 | K | Relay (... Calculated Property |
| Tfus | 390.63 | K | Relay (... Calculated Property |
| Vc | 0.623 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Panidazole.
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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