2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one
TL;DR: 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one (CAS 1023580-54-2) is a chemical compound with molecular formula C9H10BrNO3 and molecular weight 258.9844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethanone
Also Known As: 2-amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one, 2-amino-1-(2-bromo-4-hydroxy-5-methoxy-phenyl)ethanone, 2-amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethanone
Technical Specifications
| Molecular Formula | C9H10BrNO3 |
| Molecular Weight | 258.9844 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.9844 Da |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
| SMILES | COC1=C(C=C(C(=C1)C(=O)CN)Br)O |
| InChIKey | WIQYQVFLCJJVOD-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one
Property Insights of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one. Following Lipinski's Rule of Five, 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one has 2 hydrogen bond donor(s) and 4 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-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one?
The CAS number of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one is 1023580-54-2.
What is the molecular formula of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one?
The molecular formula of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one is C9H10BrNO3.
What is the molecular weight of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one?
The molecular weight of 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one is 258.9844 g/mol.
Where can I buy 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one?
You can request a quote for 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-Amino-1-(2-bromo-4-hydroxy-5-methoxyphenyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.