3-Methoxy-5-methylbenzoic acid
TL;DR: 3-Methoxy-5-methylbenzoic acid (CAS 62089-34-3) 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.
3-methoxy-5-methylbenzoic acid
Also Known As: 3-Methoxy-5-methylbenzoic acid, 3-Methoxy-5-methyl-benzoic acid, null, 3-Methoxy-5-methylbenzoicacid, Benzoic acid, 3-methoxy-5-methyl-
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 62089-34-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OC)C(=O)O |
| InChIKey | ALUKWQVSCATDLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxy-5-methylbenzoic acid (CAS 62089-34-3), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 3-methoxy-5-methylbenzoic acid.
Chemical Property Profile of 3-Methoxy-5-methylbenzoic acid
Property Insights of 3-Methoxy-5-methylbenzoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-5-methylbenzoic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 3-Methoxy-5-methylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-5-methylbenzoic acid 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
Frequently Asked Questions
What is the CAS number of 3-Methoxy-5-methylbenzoic acid?
The CAS number of 3-Methoxy-5-methylbenzoic acid is 62089-34-3.
What is the molecular formula of 3-Methoxy-5-methylbenzoic acid?
The molecular formula of 3-Methoxy-5-methylbenzoic acid is C9H10O3.
What is the molecular weight of 3-Methoxy-5-methylbenzoic acid?
The molecular weight of 3-Methoxy-5-methylbenzoic acid is 166.06 g/mol.
Where can I buy 3-Methoxy-5-methylbenzoic acid?
You can request a quote for 3-Methoxy-5-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-5-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-5-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.