3-Methylanilinium
TL;DR: 3-Methylanilinium (CAS 139956-93-7) is a chemical compound with molecular formula C7H10N+ and molecular weight 108.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methylphenyl)azanium
Also Known As: 3-methylanilinium, m-Toluidinium, (3-methylphenyl)azanium, Aminylium, (3-methylphenyl)-, Zinc,bromo[1-(trifluoromethyl)ethenyl]
| Molecular Formula | C7H10N+ |
|---|---|
| Molecular Weight | 108.08 g/mol |
| LogP | 0.86842 |
| Topological Polar Surface Area | 27.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 108.08132 |
| Heavy Atoms | 8 |
| Complexity | 164.24663 |
Chemical Identifiers
| CAS Number | 139956-93-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)[NH3+] |
Product Overview
3-Methylanilinium (CAS 139956-93-7), with molecular formula C7H10N+ and molecular weight 108.08 g/mol. IUPAC: (3-methylphenyl)azanium.
Chemical Property Profile of 3-Methylanilinium
Property Insights of 3-Methylanilinium
The XLogP value of 0.86842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylanilinium. With a topological polar surface area (TPSA) of 27.64 Ų, 3-Methylanilinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylanilinium has 1 hydrogen bond donor(s) and 0 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-Methylanilinium?
The CAS number of 3-Methylanilinium is 139956-93-7.
What is the molecular formula of 3-Methylanilinium?
The molecular formula of 3-Methylanilinium is C7H10N+.
What is the molecular weight of 3-Methylanilinium?
The molecular weight of 3-Methylanilinium is 108.08 g/mol.
Where can I buy 3-Methylanilinium?
You can request a quote for 3-Methylanilinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylanilinium?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylanilinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.