紫丁香醇
TL;DR: 紫丁香醇 (CAS 530-56-3) 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.
紫丁香醇
4-(hydroxymethyl)-2,6-dimethoxyphenol
Also Known As: Syringyl alcohol, syringic alcohol, 4-HYDROXY-3,5-DIMETHOXYBENZYL ALCOHOL, 4-(Hydroxymethyl)-2,6-dimethoxyphenol, 3,5-Dimethoxy-4-hydroxybenzyl alcohol
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 530-56-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)CO |
| InChIKey | LUOAEJWSKPQLJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
紫丁香醇 (CAS 530-56-3), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: 4-(hydroxymethyl)-2,6-dimethoxyphenol.
Chemical Property Profile of 紫丁香醇
Property Insights of 紫丁香醇
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 紫丁香醇. With a topological polar surface area (TPSA) of 58.9 Ų, 紫丁香醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 紫丁香醇 has 2 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 紫丁香醇?
The CAS number of 紫丁香醇 is 530-56-3.
What is the molecular formula of 紫丁香醇?
The molecular formula of 紫丁香醇 is C9H12O4.
What is the molecular weight of 紫丁香醇?
The molecular weight of 紫丁香醇 is 184.07 g/mol.
Where can I buy 紫丁香醇?
You can request a quote for 紫丁香醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 紫丁香醇?
Yes, KEHONG BIO provides custom synthesis services for 紫丁香醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.