4-Hydroxy-3,5-dimethylbenzoic acid
TL;DR: 4-Hydroxy-3,5-dimethylbenzoic acid (CAS 4919-37-3) 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.
4-hydroxy-3,5-dimethylbenzoic acid
Also Known As: 4-Hydroxy-3,5-dimethylbenzoic acid, 3,5-Dimethyl-4-hydroxybenzoic acid, Benzoic acid, 4-hydroxy-3,5-dimethyl-, Benzoic acid,5-dimethyl-, 2,2'-Thiodisuccinic acid
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 0.9 |
| 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 | 167.0 |
Chemical Identifiers
| CAS Number | 4919-37-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)C)C(=O)O |
| InChIKey | OMNHTTWQSSUZHO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-3,5-dimethylbenzoic acid (CAS 4919-37-3), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 4-hydroxy-3,5-dimethylbenzoic acid.
Chemical Property Profile of 4-Hydroxy-3,5-dimethylbenzoic acid
Property Insights of 4-Hydroxy-3,5-dimethylbenzoic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-3,5-dimethylbenzoic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 4-Hydroxy-3,5-dimethylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-3,5-dimethylbenzoic 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-Hydroxy-3,5-dimethylbenzoic acid?
The CAS number of 4-Hydroxy-3,5-dimethylbenzoic acid is 4919-37-3.
What is the molecular formula of 4-Hydroxy-3,5-dimethylbenzoic acid?
The molecular formula of 4-Hydroxy-3,5-dimethylbenzoic acid is C9H10O3.
What is the molecular weight of 4-Hydroxy-3,5-dimethylbenzoic acid?
The molecular weight of 4-Hydroxy-3,5-dimethylbenzoic acid is 166.06 g/mol.
Where can I buy 4-Hydroxy-3,5-dimethylbenzoic acid?
You can request a quote for 4-Hydroxy-3,5-dimethylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3,5-dimethylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3,5-dimethylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.