![5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid structure](/static/products/100/1002970-27-5.webp)
5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid
TL;DR: 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid (CAS 1002970-27-5) is a chemical compound with molecular formula C14H10BrFO3 and molecular weight 323.97974 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-2-[(3-fluorophenyl)methoxy]benzoic acid
Also Known As: 5-bromo-2-[(3-fluorophenyl)methoxy]benzoic Acid, 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid, Benzoic acid, 5-bromo-2-[(3-fluorophenyl)methoxy]-
Technical Specifications
| Molecular Formula | C14H10BrFO3 |
| Molecular Weight | 323.97974 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.97974 Da |
| Heavy Atoms | 19 |
| Complexity | 313.0 |
| SMILES | C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)Br)C(=O)O |
| InChIKey | UHVIMGXNJNCOQH-UHFFFAOYSA-N |
Chemical Property Profile of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid
Property Insights of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid
The XLogP value of 3.7 indicates that 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid has 1 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 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid?
The CAS number of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid is 1002970-27-5.
What is the molecular formula of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid?
The molecular formula of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid is C14H10BrFO3.
What is the molecular weight of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid?
The molecular weight of 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid is 323.97974 g/mol.
Where can I buy 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid?
You can request a quote for 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid?
Yes, CoreyChem provides custom synthesis services for 5-Bromo-2-{[(3-fluorophenyl)methyl]oxy}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.