- InChI
- InChI=1S/C10H4N2O9/c13-9(5-1-3-7(19-5)11(15)16)21-10(14)6-2-4-8(20-6)12(17)18/h1-4H
- InChI Key
- AUKYKYFQJGYKJN-UHFFFAOYSA-N
- Formula
- C10H4N2O9
- SMILES
-
O=C(OC(=O)c1ccc([N+](=O)[O-])o
1)c1ccc([N+](=O)[O-])o1 - Molecular Weight1
- 296.15
- CAS
- 33794-66-0
- 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 | 0.9352 | Relay (1.0) Calculated Property | |
| ΔfG° | -251.79 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -560.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 100.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.16 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.686 | Crippen Calculated Property | |
| McVol | 168.430 | ml/mol | McGowan Calculated Property |
| Pc | 3202.27 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 611.69 | K | Relay (1.0) Calculated Property |
| Tc | 923.09 | K | Relay (1.0) Calculated Property |
| Tfus | 405.11 | K | Relay (1.0) Calculated Property |
| Vc | 0.658 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Furoic acid, 5-nitro-,anhydride.
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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