- InChI
- InChI=1S/C14H18N4O4/c1-3-5-6-11(4-2)10-15-16-13-8-7-12(17(19)20)9-14(13)18(21)22/h6-10,16H,3-5H2,1-2H3/b11-6+,15-10+
- InChI Key
- XLEDIUKLRZIKQG-FDCMAIFOSA-N
- Formula
- C14H18N4O4
- SMILES
-
CCCC=C(C=NNc1ccc([N+](=O)[O-])
cc1[N+](=O)[O-])CC - Molecular Weight1
- 306.32
- CAS
- 10324-64-8
- 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 | 0.8955 | Relay (... Calculated Property | |
| ΔfG° | 417.48 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 126.88 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 97.10 | kJ/mol | Relay (... Calculated Property |
| IE | 8.40 | eV | Relay (... Calculated Property |
| log10WS | -4.97 | Relay (... Calculated Property | |
| logPoct/wat | 4.037 | Crippen Calculated Property | |
| McVol | 230.560 | ml/mol | McGowan Calculated Property |
| Pc | 1937.24 | kPa | Joback Calculated Property |
| Tboil | 625.54 | K | Relay (... Calculated Property |
| Tc | 943.97 | K | Relay (... Calculated Property |
| Tfus | 376.42 | K | Relay (... Calculated Property |
| Vc | 0.773 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2-Ethylhexenal-2, 2,4-dinitrophenyl hydrazone.
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
- Joback Method
- McGowan Method
- NIST Webbook
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