4,6-Dimethylsalicylic acid
TL;DR: 4,6-Dimethylsalicylic acid (CAS 6370-32-7) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-4,6-dimethylbenzoic acid
Also Known As: 2-Hydroxy-4,6-dimethylbenzoic acid, 4,6-Dimethylsalicylic acid, 2,6-hydroxy, 2, 6-hydroxy-, 2,4-dimethyl-6-hydroxybenzoic acid
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 6370-32-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)O)C(=O)O)C |
| InChIKey | OQDPLEDHXOOBPW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-Dimethylsalicylic acid (CAS 6370-32-7), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 2-hydroxy-4,6-dimethylbenzoic acid.
Chemical Property Profile of 4,6-Dimethylsalicylic acid
Property Insights of 4,6-Dimethylsalicylic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dimethylsalicylic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 4,6-Dimethylsalicylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dimethylsalicylic acid has 2 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 4,6-Dimethylsalicylic acid?
The CAS number of 4,6-Dimethylsalicylic acid is 6370-32-7.
What is the molecular formula of 4,6-Dimethylsalicylic acid?
The molecular formula of 4,6-Dimethylsalicylic acid is C9H10O3.
What is the molecular weight of 4,6-Dimethylsalicylic acid?
The molecular weight of 4,6-Dimethylsalicylic acid is 166.06 g/mol.
Where can I buy 4,6-Dimethylsalicylic acid?
You can request a quote for 4,6-Dimethylsalicylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dimethylsalicylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dimethylsalicylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.