(3,5-Dimethoxyphenyl)acetic acid
TL;DR: (3,5-Dimethoxyphenyl)acetic acid (CAS 4671-68-5) 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-(3,5-dimethoxyphenyl)acetic acid
Also Known As: 3,5-Dimethoxyphenylacetic acid, 2-(3,5-dimethoxyphenyl)acetic acid, (3,5-dimethoxyphenyl)acetic acid, ISOSTEARICACID, benzeneacetic acid, 3,5-dimethoxy-
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 4671-68-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)CC(=O)O)OC |
| InChIKey | FFPAFDDLAGTGPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,5-Dimethoxyphenyl)acetic acid (CAS 4671-68-5), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: 2-(3,5-dimethoxyphenyl)acetic acid.
Chemical Property Profile of (3,5-Dimethoxyphenyl)acetic acid
Property Insights of (3,5-Dimethoxyphenyl)acetic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-Dimethoxyphenyl)acetic acid. With a topological polar surface area (TPSA) of 55.8 Ų, (3,5-Dimethoxyphenyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,5-Dimethoxyphenyl)acetic 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 (3,5-Dimethoxyphenyl)acetic acid?
The CAS number of (3,5-Dimethoxyphenyl)acetic acid is 4671-68-5.
What is the molecular formula of (3,5-Dimethoxyphenyl)acetic acid?
The molecular formula of (3,5-Dimethoxyphenyl)acetic acid is C10H12O4.
What is the molecular weight of (3,5-Dimethoxyphenyl)acetic acid?
The molecular weight of (3,5-Dimethoxyphenyl)acetic acid is 196.07 g/mol.
Where can I buy (3,5-Dimethoxyphenyl)acetic acid?
You can request a quote for (3,5-Dimethoxyphenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-Dimethoxyphenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (3,5-Dimethoxyphenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.