Aucuparin
TL;DR: Aucuparin (CAS 3687-28-3) is a chemical compound with molecular formula C14H14O3 and molecular weight 230.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethoxy-4-phenylphenol
Also Known As: Aucuparin, 2,6-dimethoxy-4-phenylphenol, Aucaparin, 2,6-dimethoxy-4-phenyl-phenol, 3,5-dimethoxybiphenyl-4-ol
| Molecular Formula | C14H14O3 |
|---|---|
| Molecular Weight | 230.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.0943 |
| Heavy Atoms | 17 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 3687-28-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C2=CC=CC=C2 |
| InChIKey | KCKBEANTNJGRCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aucuparin (CAS 3687-28-3), with molecular formula C14H14O3 and molecular weight 230.09 g/mol. IUPAC: 2,6-dimethoxy-4-phenylphenol.
Chemical Property Profile of Aucuparin
Property Insights of Aucuparin
The XLogP value of 3.1 indicates that Aucuparin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, Aucuparin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aucuparin 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 Aucuparin?
The CAS number of Aucuparin is 3687-28-3.
What is the molecular formula of Aucuparin?
The molecular formula of Aucuparin is C14H14O3.
What is the molecular weight of Aucuparin?
The molecular weight of Aucuparin is 230.09 g/mol.
Where can I buy Aucuparin?
You can request a quote for Aucuparin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aucuparin?
Yes, KEHONG BIO provides custom synthesis services for Aucuparin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.