2,4-Dimethoxy-6-methylbenzoic acid
TL;DR: 2,4-Dimethoxy-6-methylbenzoic acid (CAS 736136-21-3) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethoxy-6-methylbenzoic acid
Also Known As: 2,4-Dimethoxy-6-methylbenzoic acid, O,O-Dimethylorsellinic acid, o-Toluic acid, 4,6-dimethoxy-, Orsellinic acid dimethylether, Orsellinic acid dimethyl ether
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 736136-21-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C(=O)O)OC)OC |
| InChIKey | FRBJDEWCBGUODU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dimethoxy-6-methylbenzoic acid (CAS 736136-21-3), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: 2,4-dimethoxy-6-methylbenzoic acid.
Chemical Property Profile of 2,4-Dimethoxy-6-methylbenzoic acid
Property Insights of 2,4-Dimethoxy-6-methylbenzoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethoxy-6-methylbenzoic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 2,4-Dimethoxy-6-methylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethoxy-6-methylbenzoic acid has 1 hydrogen bond donor(s) and 4 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 2,4-Dimethoxy-6-methylbenzoic acid?
The CAS number of 2,4-Dimethoxy-6-methylbenzoic acid is 736136-21-3.
What is the molecular formula of 2,4-Dimethoxy-6-methylbenzoic acid?
The molecular formula of 2,4-Dimethoxy-6-methylbenzoic acid is C10H12O4.
What is the molecular weight of 2,4-Dimethoxy-6-methylbenzoic acid?
The molecular weight of 2,4-Dimethoxy-6-methylbenzoic acid is 196.07 g/mol.
Where can I buy 2,4-Dimethoxy-6-methylbenzoic acid?
You can request a quote for 2,4-Dimethoxy-6-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethoxy-6-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethoxy-6-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.