5-Bromo-2-hydroxyhippuric acid
TL;DR: 5-Bromo-2-hydroxyhippuric acid (CAS 6966-43-4) is a chemical compound with molecular formula C9H8BrNO4 and molecular weight 272.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-bromo-2-hydroxybenzoyl)amino]acetic acid
Also Known As: 5-Bromo-2-hydroxyhippuric acid, starbld0002858, n-(5-bromo-2-hydroxybenzoyl)glycine, (5-Bromo-2-hydroxybenzoyl)glycine, 2-[(5-bromo-2-hydroxybenzoyl)amino]acetic acid
| Molecular Formula | C9H8BrNO4 |
|---|---|
| Molecular Weight | 272.96 g/mol |
| LogP | 0.9691 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.96368 |
| Heavy Atoms | 15 |
| Complexity | 405.09885 |
Chemical Identifiers
| CAS Number | 6966-43-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)C(=O)NCC(=O)O)O |
Product Overview
5-Bromo-2-hydroxyhippuric acid (CAS 6966-43-4), with molecular formula C9H8BrNO4 and molecular weight 272.96 g/mol. IUPAC: 2-[(5-bromo-2-hydroxybenzoyl)amino]acetic acid.
Chemical Property Profile of 5-Bromo-2-hydroxyhippuric acid
Property Insights of 5-Bromo-2-hydroxyhippuric acid
The XLogP value of 0.9691 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-hydroxyhippuric acid. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-2-hydroxyhippuric acid. Following Lipinski's Rule of Five, 5-Bromo-2-hydroxyhippuric acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Bromo-2-hydroxyhippuric acid?
The CAS number of 5-Bromo-2-hydroxyhippuric acid is 6966-43-4.
What is the molecular formula of 5-Bromo-2-hydroxyhippuric acid?
The molecular formula of 5-Bromo-2-hydroxyhippuric acid is C9H8BrNO4.
What is the molecular weight of 5-Bromo-2-hydroxyhippuric acid?
The molecular weight of 5-Bromo-2-hydroxyhippuric acid is 272.96 g/mol.
Where can I buy 5-Bromo-2-hydroxyhippuric acid?
You can request a quote for 5-Bromo-2-hydroxyhippuric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-2-hydroxyhippuric acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-hydroxyhippuric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.