1-O-Demethyl-FR-202306
TL;DR: 1-O-Demethyl-FR-202306 (CAS 197316-54-4) is a chemical compound with molecular formula C9H10O5 and molecular weight 198.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-1,3-dihydro-2-benzofuran-1,5,6,7-tetrol
Also Known As: 1-O-Demethyl-FR-202306, 4-Methyl-1,3-dihydro-2-benzofuran-1,5,6,7-tetrol, J2.373.978J, 1,3-Dihydro-4-methyl-1,5,6,7-isobenzofurantetraol, 4-Methyl-1,3-dihydroisobenzofuran-1,5,6,7-tetraol
| Molecular Formula | C9H10O5 |
|---|---|
| Molecular Weight | 198.05 g/mol |
| LogP | 0.63292 |
| Topological Polar Surface Area | 90.15 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.05283 |
| Heavy Atoms | 14 |
| Complexity | 398.92416 |
Chemical Identifiers
| CAS Number | 197316-54-4 |
|---|---|
| SMILES | CC1=C2COC(C2=C(C(=C1O)O)O)O |
Product Overview
1-O-Demethyl-FR-202306 (CAS 197316-54-4), with molecular formula C9H10O5 and molecular weight 198.05 g/mol. IUPAC: 4-methyl-1,3-dihydro-2-benzofuran-1,5,6,7-tetrol.
Chemical Property Profile of 1-O-Demethyl-FR-202306
Property Insights of 1-O-Demethyl-FR-202306
The XLogP value of 0.63292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-O-Demethyl-FR-202306. The TPSA of 90.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-Demethyl-FR-202306. Following Lipinski's Rule of Five, 1-O-Demethyl-FR-202306 has 4 hydrogen bond donor(s) and 5 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 1-O-Demethyl-FR-202306?
The CAS number of 1-O-Demethyl-FR-202306 is 197316-54-4.
What is the molecular formula of 1-O-Demethyl-FR-202306?
The molecular formula of 1-O-Demethyl-FR-202306 is C9H10O5.
What is the molecular weight of 1-O-Demethyl-FR-202306?
The molecular weight of 1-O-Demethyl-FR-202306 is 198.05 g/mol.
Where can I buy 1-O-Demethyl-FR-202306?
You can request a quote for 1-O-Demethyl-FR-202306 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-O-Demethyl-FR-202306?
Yes, KEHONG BIO provides custom synthesis services for 1-O-Demethyl-FR-202306 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.