- InChI
- InChI=1S/C10H12N4O4/c1-7(2)6-11-12-9-4-3-8(13(15)16)5-10(9)14(17)18/h3-7,12H,1-2H3
- InChI Key
- WYSDOKPZMGYVGI-UHFFFAOYSA-N
- Formula
- C10H12N4O4
- SMILES
-
CC(C)C=NNc1ccc([N+](=O)[O-])cc
1[N+](=O)[O-] - Molecular Weight1
- 252.23
- CAS
- 2057-82-1
- Other Names
-
- Isobutyraldehyde, 2,4-dinitrophenylhydrazone
- 2-Methylpropanal (2,4-dinitrophenyl)hydrazone
- Propanal, 2-methyl-, 2-(2,4-dinitrophenyl)hydrazone
- Isobutanal 2,4-dinitrophenylhydrazone
- 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 | 0.8016 | Relay (1.0) Calculated Property | |
| ΔfG° | 366.85 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 147.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 87.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.75 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.557 | Crippen Calculated Property | |
| McVol | 178.500 | ml/mol | McGowan Calculated Property |
| Pc | 2665.27 | kPa | Joback Calculated Property |
| Inp | 2312.00 | NIST | |
| Tboil | 585.31 | K | Relay (1.0) Calculated Property |
| Tc | 896.51 | K | Relay (1.0) Calculated Property |
| Tfus | 409.66 | K | Relay (1.0) Calculated Property |
| Vc | 0.606 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Propanal, 2-methyl-, (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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