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5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal
TL;DR: 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal (CAS 53405-99-5) is a chemical compound with molecular formula C11H9N3O5 and molecular weight 263.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,4-dinitroanilino)penta-2,4-dienal
Also Known As: Indocyanine green impurity 22, Indocyanine Green Impurity 45, 5-[(2,4-dinitrophenyl)amino]penta-2,4-dienal, 5-(2,4-dinitroanilino)penta-2,4-dienal, Glutacondialdehyd-mono-(2.4-dinitro-anil)
| Molecular Formula | C11H9N3O5 |
|---|---|
| Molecular Weight | 263.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.05423 |
| Heavy Atoms | 19 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 53405-99-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC=CC=CC=O |
| InChIKey | BKAXRHZDPTUAIN-UHFFFAOYSA-N |
Product Overview
5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal (CAS 53405-99-5), with molecular formula C11H9N3O5 and molecular weight 263.05 g/mol. IUPAC: 5-(2,4-dinitroanilino)penta-2,4-dienal.
Chemical Property Profile of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal
Property Insights of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal. Following Lipinski's Rule of Five, 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal has 1 hydrogen bond donor(s) and 6 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 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal?
The CAS number of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal is 53405-99-5.
What is the molecular formula of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal?
The molecular formula of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal is C11H9N3O5.
What is the molecular weight of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal?
The molecular weight of 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal is 263.05 g/mol.
Where can I buy 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal?
You can request a quote for 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2,4-Dinitrophenyl)amino]penta-2,4-dienal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.