Nitro-benzaldehyde-2,4-dinitrophenylhydrazone
TL;DR: Nitro-benzaldehyde-2,4-dinitrophenylhydrazone (CAS 5422-68-4) is a chemical compound with molecular formula C13H9N5O6 and molecular weight 331.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-N-[(2-nitrophenyl)methylideneamino]aniline
Also Known As: nitro-benzaldehyde-2,4-dinitrophenylhydrazone, 1-(2,4-dinitrophenyl)-2-(2-nitrobenzylidene)hydrazine, 2,4-dinitro-N-[(2-nitrophenyl)methylideneamino]aniline, 2,4-dinitro-N-[(E)-(2-nitrophenyl)methylideneamino]aniline
| Molecular Formula | C13H9N5O6 |
|---|---|
| Molecular Weight | 331.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.0553 |
| Heavy Atoms | 24 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 5422-68-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AYGKPPOWJYTVBQ-UHFFFAOYSA-N |
Product Overview
Nitro-benzaldehyde-2,4-dinitrophenylhydrazone (CAS 5422-68-4), with molecular formula C13H9N5O6 and molecular weight 331.06 g/mol. IUPAC: 2,4-dinitro-N-[(2-nitrophenyl)methylideneamino]aniline.
Chemical Property Profile of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone
Property Insights of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitro-benzaldehyde-2,4-dinitrophenylhydrazone. The TPSA of 162.0 Ų indicates high polarity, suggesting Nitro-benzaldehyde-2,4-dinitrophenylhydrazone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nitro-benzaldehyde-2,4-dinitrophenylhydrazone has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone?
The CAS number of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone is 5422-68-4.
What is the molecular formula of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone?
The molecular formula of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone is C13H9N5O6.
What is the molecular weight of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone?
The molecular weight of Nitro-benzaldehyde-2,4-dinitrophenylhydrazone is 331.06 g/mol.
Where can I buy Nitro-benzaldehyde-2,4-dinitrophenylhydrazone?
You can request a quote for Nitro-benzaldehyde-2,4-dinitrophenylhydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitro-benzaldehyde-2,4-dinitrophenylhydrazone?
Yes, KEHONG BIO provides custom synthesis services for Nitro-benzaldehyde-2,4-dinitrophenylhydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.