3,5-Dimethoxybenzoic Acid
TL;DR: 3,5-Dimethoxybenzoic Acid (CAS 1132-21-4) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dimethoxybenzoic acid
Also Known As: 3,5-DIMETHOXYBENZOIC ACID, Benzoic acid, 3,5-dimethoxy-, null, 35-Dimethoxybenzoate, 3,5-dimethoxy benzoic acid
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H10O4 |
| Molecular Weight | 182.0579 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.0579 Da |
| Heavy Atoms | 13 |
| Complexity | 168.0 |
| SMILES | COC1=CC(=CC(=C1)C(=O)O)OC |
| InChIKey | IWPZKOJSYQZABD-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Dimethoxybenzoic Acid
Property Insights of 3,5-Dimethoxybenzoic Acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethoxybenzoic Acid. With a topological polar surface area (TPSA) of 55.8 Ų, 3,5-Dimethoxybenzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethoxybenzoic 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
What is the CAS number of 3,5-Dimethoxybenzoic Acid?
The CAS number of 3,5-Dimethoxybenzoic Acid is 1132-21-4.
What is the molecular formula of 3,5-Dimethoxybenzoic Acid?
The molecular formula of 3,5-Dimethoxybenzoic Acid is C9H10O4.
What is the molecular weight of 3,5-Dimethoxybenzoic Acid?
The molecular weight of 3,5-Dimethoxybenzoic Acid is 182.0579 g/mol.
Where can I buy 3,5-Dimethoxybenzoic Acid?
You can request a quote for 3,5-Dimethoxybenzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Dimethoxybenzoic Acid?
Yes, CoreyChem provides custom synthesis services for 3,5-Dimethoxybenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.