Moracin I
TL;DR: Moracin I (CAS 73338-88-2) is a chemical compound with molecular formula C20H20O4 and molecular weight 324.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-hydroxy-3-methoxy-2-(3-methylbut-2-enyl)phenyl]-1-benzofuran-6-ol
Also Known As: moracin I, J1.454.356B, 6-Benzofuranol, 2-(5-hydroxy-3-methoxy-2-(3-methyl-2-butenyl)phenyl)-, 2-[5-hydroxy-3-methoxy-2-(3-methylbut-2-en-1-yl)phenyl]-1-benzofuran-6-ol, 6-Hydroxy-2-(5-hydroxy-3-methoxy-2-prenylphenyl)benzofuran
| Molecular Formula | C20H20O4 |
|---|---|
| Molecular Weight | 324.14 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.13617 |
| Heavy Atoms | 24 |
| Complexity | 445.0 |
| Melting Point | 139 - 140 °C |
Chemical Identifiers
| CAS Number | 73338-88-2 |
|---|---|
| SMILES | CC(=CCC1=C(C=C(C=C1OC)O)C2=CC3=C(O2)C=C(C=C3)O)C |
| InChIKey | MRJQFSZVXAESPR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Moracin I (CAS 73338-88-2), with molecular formula C20H20O4 and molecular weight 324.14 g/mol. IUPAC: 2-[5-hydroxy-3-methoxy-2-(3-methylbut-2-enyl)phenyl]-1-benzofuran-6-ol.
Chemical Property Profile of Moracin I
Property Insights of Moracin I
The XLogP value of 5.2 indicates that Moracin I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Moracin I. Following Lipinski's Rule of Five, Moracin I has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Moracin I?
The CAS number of Moracin I is 73338-88-2.
What is the molecular formula of Moracin I?
The molecular formula of Moracin I is C20H20O4.
What is the molecular weight of Moracin I?
The molecular weight of Moracin I is 324.14 g/mol.
Where can I buy Moracin I?
You can request a quote for Moracin I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Moracin I?
Yes, KEHONG BIO provides custom synthesis services for Moracin I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.