Phenyl 5-bromo-2-hydroxybenzoate
TL;DR: Phenyl 5-bromo-2-hydroxybenzoate (CAS 10268-63-0) is a chemical compound with molecular formula C13H9BrO3 and molecular weight 291.9735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl 5-bromo-2-hydroxybenzoate
Also Known As: phenyl 5-bromo-2-hydroxybenzoate, phenyl 5-bromosalicylate, phenyl5-bromo-2-hydroxybenzoate, 5-bromo-2-hydroxy-benzoic acid phenyl ester, Benzoic acid,5-bromo-2-hydroxy-, phenyl ester
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H9BrO3 |
| Molecular Weight | 291.9735 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.9735 Da |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
| SMILES | C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)O |
| InChIKey | IRDJLIBTYFENSX-UHFFFAOYSA-N |
Chemical Property Profile of Phenyl 5-bromo-2-hydroxybenzoate
Property Insights of Phenyl 5-bromo-2-hydroxybenzoate
The XLogP value of 4.5 indicates that Phenyl 5-bromo-2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Phenyl 5-bromo-2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 5-bromo-2-hydroxybenzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenyl 5-bromo-2-hydroxybenzoate?
The CAS number of Phenyl 5-bromo-2-hydroxybenzoate is 10268-63-0.
What is the molecular formula of Phenyl 5-bromo-2-hydroxybenzoate?
The molecular formula of Phenyl 5-bromo-2-hydroxybenzoate is C13H9BrO3.
What is the molecular weight of Phenyl 5-bromo-2-hydroxybenzoate?
The molecular weight of Phenyl 5-bromo-2-hydroxybenzoate is 291.9735 g/mol.
Where can I buy Phenyl 5-bromo-2-hydroxybenzoate?
You can request a quote for Phenyl 5-bromo-2-hydroxybenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenyl 5-bromo-2-hydroxybenzoate?
Yes, CoreyChem provides custom synthesis services for Phenyl 5-bromo-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.