2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid
TL;DR: 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid (CAS 60935-39-9) is a chemical compound with molecular formula C9H9BrO3 and molecular weight 243.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-3-hydroxy-4,6-dimethylbenzoic acid
Also Known As: 2-bromo-3-hydroxy-4,6-dimethylbenzoic acid, 2-bromo-4,6-dimethyl-3-hydroxybenzoic acid, 2-bromo-3-hydroxy-4,6-dimethyl-benzoic Acid, 665-815-1, RefChem:466402
| Molecular Formula | C9H9BrO3 |
|---|---|
| Molecular Weight | 243.97 g/mol |
| LogP | 2.46974 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.97351 |
| Heavy Atoms | 13 |
| Complexity | 371.61282 |
Chemical Identifiers
| CAS Number | 60935-39-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C(=O)O)Br)O)C |
Product Overview
2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid (CAS 60935-39-9), with molecular formula C9H9BrO3 and molecular weight 243.97 g/mol. IUPAC: 2-bromo-3-hydroxy-4,6-dimethylbenzoic acid.
Chemical Property Profile of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid
Property Insights of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid
The XLogP value of 2.46974 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid. With a topological polar surface area (TPSA) of 57.53 Ų, 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid has 2 hydrogen bond donor(s) and 2 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 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid?
The CAS number of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid is 60935-39-9.
What is the molecular formula of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid?
The molecular formula of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid is C9H9BrO3.
What is the molecular weight of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid?
The molecular weight of 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid is 243.97 g/mol.
Where can I buy 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid?
You can request a quote for 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4,6-dimethyl-3-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.