4-碘苯胺
TL;DR: 4-碘苯胺 (CAS 540-37-4) is a chemical compound with molecular formula C6H6IN and molecular weight 218.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-碘苯胺
4-iodoaniline
Also Known As: 4-IODOANILINE, p-Iodoaniline, Benzenamine, 4-iodo-, 4-Iodobenzenamine, 4-iodophenylamine
| Molecular Formula | C6H6IN |
|---|---|
| Molecular Weight | 218.95 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.9545 |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
| Vapor Pressure | 0.00767 [mmHg] |
Chemical Identifiers
| CAS Number | 540-37-4 |
|---|---|
| SMILES | C1=CC(=CC=C1N)I |
| InChIKey | VLVCDUSVTXIWGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-碘苯胺 (CAS 540-37-4), with molecular formula C6H6IN and molecular weight 218.95 g/mol. IUPAC: 4-iodoaniline.
Chemical Property Profile of 4-碘苯胺
Property Insights of 4-碘苯胺
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-碘苯胺. With a topological polar surface area (TPSA) of 26.0 Ų, 4-碘苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-碘苯胺 has 1 hydrogen bond donor(s) and 1 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-碘苯胺?
The CAS number of 4-碘苯胺 is 540-37-4.
What is the molecular formula of 4-碘苯胺?
The molecular formula of 4-碘苯胺 is C6H6IN.
What is the molecular weight of 4-碘苯胺?
The molecular weight of 4-碘苯胺 is 218.95 g/mol.
Where can I buy 4-碘苯胺?
You can request a quote for 4-碘苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-碘苯胺?
Yes, KEHONG BIO provides custom synthesis services for 4-碘苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.