2-(3-Bromo-4-methoxyphenyl)ethan-1-amine
TL;DR: 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine (CAS 159465-27-7) is a chemical compound with molecular formula C9H12BrNO and molecular weight 229.01022 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-bromo-4-methoxyphenyl)ethanamine
Also Known As: 3-Bromo-4-methoxyphenethylamine, 2-(3-bromo-4-methoxyphenyl)ethanamine, 2-(3-bromo-4-methoxyphenyl)ethan-1-amine, Benzeneethanamine, 3-bromo-4-methoxy-, 2-(3-bromo-4-methoxyphenyl)ethylamine
Technical Specifications
| Molecular Formula | C9H12BrNO |
| Molecular Weight | 229.01022 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.01022 Da |
| Heavy Atoms | 12 |
| Complexity | 132.0 |
| SMILES | COC1=C(C=C(C=C1)CCN)Br |
| InChIKey | JHVALSRTUOVNLL-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine
Property Insights of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine. With a topological polar surface area (TPSA) of 35.3 Ų, 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine 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 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine?
The CAS number of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine is 159465-27-7.
What is the molecular formula of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine?
The molecular formula of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine is C9H12BrNO.
What is the molecular weight of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine?
The molecular weight of 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine is 229.01022 g/mol.
Where can I buy 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine?
You can request a quote for 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine?
Yes, CoreyChem provides custom synthesis services for 2-(3-Bromo-4-methoxyphenyl)ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.