- InChI
- InChI=1S/C11H9N3O4/c15-11(9-6-7-10(18-9)14(16)17)13-12-8-4-2-1-3-5-8/h1-7,12H,(H,13,15)
- InChI Key
- CKMTVTCQCSEKSS-UHFFFAOYSA-N
- Formula
- C11H9N3O4
- SMILES
-
O=C(NNc1ccccc1)c1ccc([N+](=O)[
O-])o1 - Molecular Weight1
- 247.21
- CAS
- 103854-67-7
- 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 | 0.7425 | Relay (1.0) Calculated Property | |
| ΔfG° | 191.22 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -40.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 107.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.08 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.46 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.945 | Crippen Calculated Property | |
| McVol | 167.450 | ml/mol | McGowan Calculated Property |
| Pc | 4682.12 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 620.18 | K | Relay (1.0) Calculated Property |
| Tc | 970.25 | K | Relay (1.0) Calculated Property |
| Tfus | 451.56 | K | Relay (1.0) Calculated Property |
| Vc | 0.602 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Furoic acid, 5-nitro-, 2-phenyl-1-hydrazide.
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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