5-Bromo-o-toluidine
TL;DR: 5-Bromo-o-toluidine (CAS 39503-51-0) is a chemical compound with molecular formula C7H8BrN and molecular weight 184.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-methylaniline
Also Known As: 5-Bromo-2-methylaniline, 5-Bromo-o-toluidine, 2-Amino-4-Bromotoluene, 5-bromo-2-methyl-aniline, Nitrosylsulfuricacid
| Molecular Formula | C7H8BrN |
|---|---|
| Molecular Weight | 184.98 g/mol |
| LogP | 2.33972 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.98401 |
| Heavy Atoms | 9 |
| Complexity | 220.15617 |
Chemical Identifiers
| CAS Number | 39503-51-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Br)N |
Product Overview
5-Bromo-o-toluidine (CAS 39503-51-0), with molecular formula C7H8BrN and molecular weight 184.98 g/mol. IUPAC: 5-bromo-2-methylaniline.
Chemical Property Profile of 5-Bromo-o-toluidine
Property Insights of 5-Bromo-o-toluidine
The XLogP value of 2.33972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-o-toluidine. With a topological polar surface area (TPSA) of 26.02 Ų, 5-Bromo-o-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-o-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 5-Bromo-o-toluidine?
The CAS number of 5-Bromo-o-toluidine is 39503-51-0.
What is the molecular formula of 5-Bromo-o-toluidine?
The molecular formula of 5-Bromo-o-toluidine is C7H8BrN.
What is the molecular weight of 5-Bromo-o-toluidine?
The molecular weight of 5-Bromo-o-toluidine is 184.98 g/mol.
Where can I buy 5-Bromo-o-toluidine?
You can request a quote for 5-Bromo-o-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-o-toluidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-o-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.