4-硝基碘苯
TL;DR: 4-硝基碘苯 (CAS 636-98-6) is a chemical compound with molecular formula C6H4INO2 and molecular weight 248.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基碘苯
1-iodo-4-nitrobenzene
Also Known As: 1-Iodo-4-nitrobenzene, p-Iodonitrobenzene, 4-IODONITROBENZENE, p-Nitroiodobenzene, Benzene, 1-iodo-4-nitro-
| Molecular Formula | C6H4INO2 |
|---|---|
| Molecular Weight | 248.93 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.92868 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 636-98-6 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])I |
| InChIKey | SCCCFNJTCDSLCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基碘苯 (CAS 636-98-6), with molecular formula C6H4INO2 and molecular weight 248.93 g/mol. IUPAC: 1-iodo-4-nitrobenzene.
Chemical Property Profile of 4-硝基碘苯
Property Insights of 4-硝基碘苯
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-硝基碘苯. With a topological polar surface area (TPSA) of 45.8 Ų, 4-硝基碘苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-硝基碘苯 has 0 hydrogen bond donor(s) and 2 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-硝基碘苯?
The CAS number of 4-硝基碘苯 is 636-98-6.
What is the molecular formula of 4-硝基碘苯?
The molecular formula of 4-硝基碘苯 is C6H4INO2.
What is the molecular weight of 4-硝基碘苯?
The molecular weight of 4-硝基碘苯 is 248.93 g/mol.
Where can I buy 4-硝基碘苯?
You can request a quote for 4-硝基碘苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基碘苯?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基碘苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.