m-Toluidine
TL;DR: m-Toluidine (CAS 108-44-1) is a chemical compound with molecular formula C7H9N and molecular weight 107.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylaniline
Also Known As: m-Toluidine, 3-Methylaniline, 3-Toluidine, m-Methylaniline, m-Aminotoluene
| Molecular Formula | C7H9N |
|---|---|
| Molecular Weight | 107.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 107.0735 |
| Heavy Atoms | 8 |
| Complexity | 70.0 |
| Melting Point | -30.4 °C |
| Boiling Point | 203.4 °C at 760 mmHg |
| Density | 0.989 at 20.0 °C - Less dense than water; will float |
| Solubility | 2 % (NIOSH, 2024) |
| Flash Point | 85.6 °C |
| Vapor Pressure | 1 mmHg at 41.1 °C |
| Refractive Index | 1.5681 at 20 °C |
Chemical Identifiers
| CAS Number | 108-44-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N |
| InChIKey | JJYPMNFTHPTTDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
m-Toluidine (CAS 108-44-1), with molecular formula C7H9N and molecular weight 107.07 g/mol. IUPAC: 3-methylaniline.
Chemical Property Profile of m-Toluidine
Property Insights of m-Toluidine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-Toluidine. With a topological polar surface area (TPSA) of 26.0 Ų, m-Toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, m-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 m-Toluidine?
The CAS number of m-Toluidine is 108-44-1.
What is the molecular formula of m-Toluidine?
The molecular formula of m-Toluidine is C7H9N.
What is the molecular weight of m-Toluidine?
The molecular weight of m-Toluidine is 107.07 g/mol.
Where can I buy m-Toluidine?
You can request a quote for m-Toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Toluidine?
Yes, KEHONG BIO provides custom synthesis services for m-Toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.