2-Bromo-5-methoxyterephthalic acid
TL;DR: 2-Bromo-5-methoxyterephthalic acid (CAS 154546-92-6) is a chemical compound with molecular formula C9H7BrO5 and molecular weight 273.9477 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-5-methoxyterephthalic acid
Also Known As: 2-bromo-5-methoxyterephthalic acid, 2-Bromo-5-methoxy-1,4-benzenedicarboxylic acid, 2-bromo-5-methoxybenzene-1,4-dicarboxylic acid
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H7BrO5 |
| Molecular Weight | 273.9477 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.9477 Da |
| Heavy Atoms | 15 |
| Complexity | 267.0 |
| SMILES | COC1=C(C=C(C(=C1)C(=O)O)Br)C(=O)O |
| InChIKey | RSRQQKLFLIIEFS-UHFFFAOYSA-N |
Chemical Property Profile of 2-Bromo-5-methoxyterephthalic acid
Property Insights of 2-Bromo-5-methoxyterephthalic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-5-methoxyterephthalic acid. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-5-methoxyterephthalic acid. Following Lipinski's Rule of Five, 2-Bromo-5-methoxyterephthalic acid has 2 hydrogen bond donor(s) and 5 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-Bromo-5-methoxyterephthalic acid?
The CAS number of 2-Bromo-5-methoxyterephthalic acid is 154546-92-6.
What is the molecular formula of 2-Bromo-5-methoxyterephthalic acid?
The molecular formula of 2-Bromo-5-methoxyterephthalic acid is C9H7BrO5.
What is the molecular weight of 2-Bromo-5-methoxyterephthalic acid?
The molecular weight of 2-Bromo-5-methoxyterephthalic acid is 273.9477 g/mol.
Where can I buy 2-Bromo-5-methoxyterephthalic acid?
You can request a quote for 2-Bromo-5-methoxyterephthalic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Bromo-5-methoxyterephthalic acid?
Yes, CoreyChem provides custom synthesis services for 2-Bromo-5-methoxyterephthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.