4'-Iodo-2,4-dinitrodiphenylamine
TL;DR: 4'-Iodo-2,4-dinitrodiphenylamine (CAS 16220-59-0) is a chemical compound with molecular formula C12H8IN3O4 and molecular weight 384.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-iodophenyl)-2,4-dinitroaniline
Also Known As: N-(4-iodophenyl)-2,4-dinitroaniline, 4'-Iodo-2,4-dinitrodiphenylamine, 4-Iodphenyl-2,4-dinitrophenylamin, 4 -Iodo-2,4-dinitrodiphenylamine, BAS 00606425
| Molecular Formula | C12H8IN3O4 |
|---|---|
| Molecular Weight | 384.96 g/mol |
| LogP | 3.8512 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.95596 |
| Heavy Atoms | 20 |
| Complexity | 672.9027 |
Chemical Identifiers
| CAS Number | 16220-59-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])I |
Product Overview
4'-Iodo-2,4-dinitrodiphenylamine (CAS 16220-59-0), with molecular formula C12H8IN3O4 and molecular weight 384.96 g/mol. IUPAC: N-(4-iodophenyl)-2,4-dinitroaniline.
Chemical Property Profile of 4'-Iodo-2,4-dinitrodiphenylamine
Property Insights of 4'-Iodo-2,4-dinitrodiphenylamine
The XLogP value of 3.8512 indicates that 4'-Iodo-2,4-dinitrodiphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Iodo-2,4-dinitrodiphenylamine. Following Lipinski's Rule of Five, 4'-Iodo-2,4-dinitrodiphenylamine has 1 hydrogen bond donor(s) and 5 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 4'-Iodo-2,4-dinitrodiphenylamine?
The CAS number of 4'-Iodo-2,4-dinitrodiphenylamine is 16220-59-0.
What is the molecular formula of 4'-Iodo-2,4-dinitrodiphenylamine?
The molecular formula of 4'-Iodo-2,4-dinitrodiphenylamine is C12H8IN3O4.
What is the molecular weight of 4'-Iodo-2,4-dinitrodiphenylamine?
The molecular weight of 4'-Iodo-2,4-dinitrodiphenylamine is 384.96 g/mol.
Where can I buy 4'-Iodo-2,4-dinitrodiphenylamine?
You can request a quote for 4'-Iodo-2,4-dinitrodiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Iodo-2,4-dinitrodiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for 4'-Iodo-2,4-dinitrodiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.