TL;DR: 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine (CAS 1655-42-1) is a chemical compound with molecular formula C12H16N4O4 and molecular weight 280.11716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-methylpentan-2-ylideneamino)-2,4-dinitroaniline
Also Known As: METHYL ISOBUTYL KETONE-DNPH, 2-Pentanone, 4-methyl-, (2,4-dinitrophenyl)hydrazone, N-(4-methylpentan-2-ylideneamino)-2,4-dinitroaniline, Methylisobutylketon-2,4-dinitrophenylhydrazon, N-[(Z)-4-methylpentan-2-ylideneamino]-2,4-dinitroaniline
| Molecular Formula | C12H16N4O4 |
| Molecular Weight | 280.11716 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.11716 Da |
| Heavy Atoms | 20 |
| Complexity | 386.0 |
| SMILES | CC(C)CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C |
| InChIKey | UNLVZDNGQXFBAY-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine. Following Lipinski's Rule of Five, 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine is 1655-42-1.
The molecular formula of 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine is C12H16N4O4.
The molecular weight of 1-(2,4-Dinitrophenyl)-2-(4-methylpentan-2-ylidene)hydrazine is 280.11716 g/mol.
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