芥子醇
TL;DR: 芥子醇 (CAS 537-33-7) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芥子醇
4-(3-hydroxyprop-1-enyl)-2,6-dimethoxyphenol
Also Known As: Sinapyl alcohol, SINAPYLALCOHOL, 4-(3-hydroxyprop-1-en-1-yl)-2,6-dimethoxyphenol, 4-hydroxy-3,5-dimethoxy-cinnamyl alcohol, 4-(3-hydroxyprop-1-enyl)-2,6-dimethoxyphenol
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 537-33-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C=CCO |
| InChIKey | LZFOPEXOUVTGJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
芥子醇 (CAS 537-33-7), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 4-(3-hydroxyprop-1-enyl)-2,6-dimethoxyphenol.
Chemical Property Profile of 芥子醇
Property Insights of 芥子醇
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 芥子醇. With a topological polar surface area (TPSA) of 58.9 Ų, 芥子醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 芥子醇 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 芥子醇?
The CAS number of 芥子醇 is 537-33-7.
What is the molecular formula of 芥子醇?
The molecular formula of 芥子醇 is C11H14O4.
What is the molecular weight of 芥子醇?
The molecular weight of 芥子醇 is 210.09 g/mol.
Where can I buy 芥子醇?
You can request a quote for 芥子醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芥子醇?
Yes, KEHONG BIO provides custom synthesis services for 芥子醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.