3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid
TL;DR: 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid (CAS 24941-58-0) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethoxycyclohexa-2,5-diene-1-carboxylic acid
Also Known As: 1,4-dihydro-3,5-dimethoxybenzoic acid, 3,5-dimethoxycyclohexa-2,5-diene-1-carboxylic acid, 3,5-dimethoxy-2,5-cyclohexadiene-1-carboxylic acid, 2,5-Cyclohexadiene-1-carboxylicacid, 3,5-dimethoxy-, RefChem:271842
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 24941-58-0 |
|---|---|
| SMILES | COC1=CC(C=C(C1)OC)C(=O)O |
| InChIKey | FSWGOIHYIIOIJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid (CAS 24941-58-0), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: 3,5-dimethoxycyclohexa-2,5-diene-1-carboxylic acid.
Chemical Property Profile of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid
Property Insights of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic 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-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid?
The CAS number of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid is 24941-58-0.
What is the molecular formula of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid?
The molecular formula of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid is C9H12O4.
What is the molecular weight of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid?
The molecular weight of 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid is 184.07 g/mol.
Where can I buy 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid?
You can request a quote for 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic 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-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethoxycyclohexa-2,5-diene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.