5-Bromo-2-methoxyaniline
TL;DR: 5-Bromo-2-methoxyaniline (CAS 1072945-54-0) is a chemical compound with molecular formula C7H8BrNO and molecular weight 200.97893 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-2-methoxyaniline
Also Known As: 5-bromo-2-methoxyaniline, 2-Amino-4-bromoanisole, 5-bromo-2-methoxy aniline, 5-Bromo-o-anisidine, 5-bromo-2-methoxy-aniline
Technical Specifications
| Molecular Formula | C7H8BrNO |
| Molecular Weight | 200.97893 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.97893 Da |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
| SMILES | COC1=C(C=C(C=C1)Br)N |
| InChIKey | OPGNSNDTPPIYPG-UHFFFAOYSA-N |
Chemical Property Profile of 5-Bromo-2-methoxyaniline
Property Insights of 5-Bromo-2-methoxyaniline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-methoxyaniline. With a topological polar surface area (TPSA) of 35.3 Ų, 5-Bromo-2-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-methoxyaniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Bromo-2-methoxyaniline?
The CAS number of 5-Bromo-2-methoxyaniline is 1072945-54-0.
What is the molecular formula of 5-Bromo-2-methoxyaniline?
The molecular formula of 5-Bromo-2-methoxyaniline is C7H8BrNO.
What is the molecular weight of 5-Bromo-2-methoxyaniline?
The molecular weight of 5-Bromo-2-methoxyaniline is 200.97893 g/mol.
Where can I buy 5-Bromo-2-methoxyaniline?
You can request a quote for 5-Bromo-2-methoxyaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Bromo-2-methoxyaniline?
Yes, CoreyChem provides custom synthesis services for 5-Bromo-2-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.