4-Iodoaniline
TL;DR: 4-Iodoaniline (CAS 540-37-4) is a chemical compound with molecular formula C6H6IN and molecular weight 218.9545 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-iodoaniline
Also Known As: 4-IODOANILINE, p-Iodoaniline, Benzenamine, 4-iodo-, 4-Iodobenzenamine, 4-iodophenylamine
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H6IN |
| Molecular Weight | 218.9545 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.9545 Da |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
| Vapor Pressure | 0.00767 [mmHg] |
| SMILES | C1=CC(=CC=C1N)I |
| InChIKey | VLVCDUSVTXIWGW-UHFFFAOYSA-N |
Product Description
Applications: 4-Iodoaniline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Iodoaniline (CAS 540-37-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, 4-Iodoaniline (CAS 540-37-4) has the molecular formula C6H6IN and a molecular weight of 218.95 g/mol. It is also known as 4-IODOANILINE and p-Iodoaniline.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Iodoaniline
Property Insights of 4-Iodoaniline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Iodoaniline. With a topological polar surface area (TPSA) of 26.0 Ų, 4-Iodoaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Iodoaniline 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
What is the CAS number of 4-Iodoaniline?
The CAS number of 4-Iodoaniline is 540-37-4.
What is the molecular formula of 4-Iodoaniline?
The molecular formula of 4-Iodoaniline is C6H6IN.
What is the molecular weight of 4-Iodoaniline?
The molecular weight of 4-Iodoaniline is 218.9545 g/mol.
What are the applications of 4-Iodoaniline?
4-Iodoaniline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Iodoaniline (CAS 540-37-4) with custom...
Where can I buy 4-Iodoaniline?
You can request a quote for 4-Iodoaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Iodoaniline?
Yes, CoreyChem provides custom synthesis services for 4-Iodoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.