3-Iodo-p-toluidine
TL;DR: 3-Iodo-p-toluidine (CAS 35944-64-0) 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.
3-iodo-4-methylaniline
Also Known As: 3-Iodo-4-methylaniline, 3-Iodo-p-toluidine, 3-iodo-4-methyl-aniline, Benzenamine, 3-iodo-4-methyl-, p-Toluidine, 3-iodo-
| Molecular Formula | C7H8IN |
|---|---|
| Molecular Weight | 232.97 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 | 232.97015 |
| Heavy Atoms | 9 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 35944-64-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N)I |
| InChIKey | RRUDMHNAMZFNEK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Iodo-p-toluidine (CAS 35944-64-0), with molecular formula C7H8IN and molecular weight 232.97 g/mol. IUPAC: 3-iodo-4-methylaniline.
Chemical Property Profile of 3-Iodo-p-toluidine
Property Insights of 3-Iodo-p-toluidine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Iodo-p-toluidine. With a topological polar surface area (TPSA) of 26.0 Ų, 3-Iodo-p-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Iodo-p-toluidine 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 3-Iodo-p-toluidine?
The CAS number of 3-Iodo-p-toluidine is 35944-64-0.
What is the molecular formula of 3-Iodo-p-toluidine?
The molecular formula of 3-Iodo-p-toluidine is C7H8IN.
What is the molecular weight of 3-Iodo-p-toluidine?
The molecular weight of 3-Iodo-p-toluidine is 232.97 g/mol.
Where can I buy 3-Iodo-p-toluidine?
You can request a quote for 3-Iodo-p-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Iodo-p-toluidine?
Yes, KEHONG BIO provides custom synthesis services for 3-Iodo-p-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.