4-Iodo-3-methylaniline
TL;DR: 4-Iodo-3-methylaniline (CAS 4949-69-3) is a chemical compound with molecular formula C7H8IN and molecular weight 232.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-iodo-3-methylaniline
Also Known As: 4-Iodo-3-methylaniline, 4-Iodo-m-toluidine, 3-Methyl-4-iodoaniline, 2-iodo 5-aminotoluene, 4-iodo-3-methyl aniline
| Molecular Formula | C7H8IN |
|---|---|
| Molecular Weight | 232.97 g/mol |
| LogP | 2.18182 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.97015 |
| Heavy Atoms | 9 |
| Complexity | 220.15617 |
Chemical Identifiers
| CAS Number | 4949-69-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N)I |
Product Overview
4-Iodo-3-methylaniline (CAS 4949-69-3), with molecular formula C7H8IN and molecular weight 232.97 g/mol. IUPAC: 4-iodo-3-methylaniline.
Chemical Property Profile of 4-Iodo-3-methylaniline
Property Insights of 4-Iodo-3-methylaniline
The XLogP value of 2.18182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Iodo-3-methylaniline. With a topological polar surface area (TPSA) of 26.02 Ų, 4-Iodo-3-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Iodo-3-methylaniline 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-Iodo-3-methylaniline?
The CAS number of 4-Iodo-3-methylaniline is 4949-69-3.
What is the molecular formula of 4-Iodo-3-methylaniline?
The molecular formula of 4-Iodo-3-methylaniline is C7H8IN.
What is the molecular weight of 4-Iodo-3-methylaniline?
The molecular weight of 4-Iodo-3-methylaniline is 232.97 g/mol.
Where can I buy 4-Iodo-3-methylaniline?
You can request a quote for 4-Iodo-3-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Iodo-3-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Iodo-3-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.