4-Bromo-2,6-dimethoxyaniline
TL;DR: 4-Bromo-2,6-dimethoxyaniline (CAS 23957-21-3) is a chemical compound with molecular formula C8H10BrNO2 and molecular weight 230.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2,6-dimethoxyaniline
Also Known As: 4-bromo-2,6-dimethoxyaniline, 4-BROMO-2,6-DIMETHOXYBENZENAMINE, Phloroglucinol impurity 44, 4-bromo-2,6-dimethoxy-aniline, Benzenamine, 4-bromo-2,6-dimethoxy-
| Molecular Formula | C8H10BrNO2 |
|---|---|
| Molecular Weight | 230.99 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.98949 |
| Heavy Atoms | 12 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 23957-21-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1N)OC)Br |
| InChIKey | UJGUWWZOHPAMAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromo-2,6-dimethoxyaniline (CAS 23957-21-3), with molecular formula C8H10BrNO2 and molecular weight 230.99 g/mol. IUPAC: 4-bromo-2,6-dimethoxyaniline.
Chemical Property Profile of 4-Bromo-2,6-dimethoxyaniline
Property Insights of 4-Bromo-2,6-dimethoxyaniline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2,6-dimethoxyaniline. With a topological polar surface area (TPSA) of 44.5 Ų, 4-Bromo-2,6-dimethoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2,6-dimethoxyaniline has 1 hydrogen bond donor(s) and 3 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-Bromo-2,6-dimethoxyaniline?
The CAS number of 4-Bromo-2,6-dimethoxyaniline is 23957-21-3.
What is the molecular formula of 4-Bromo-2,6-dimethoxyaniline?
The molecular formula of 4-Bromo-2,6-dimethoxyaniline is C8H10BrNO2.
What is the molecular weight of 4-Bromo-2,6-dimethoxyaniline?
The molecular weight of 4-Bromo-2,6-dimethoxyaniline is 230.99 g/mol.
Where can I buy 4-Bromo-2,6-dimethoxyaniline?
You can request a quote for 4-Bromo-2,6-dimethoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2,6-dimethoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2,6-dimethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.