6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one
TL;DR: 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one (CAS 21861-32-5) is a chemical compound with molecular formula C9H8O3 and molecular weight 164.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-4-methyl-1-benzofuran-3-one
Also Known As: 6-hydroxy-4-methyl-1-benzofuran-3(2H)-one, 6-hydroxy-4-methylbenzofuran-3(2H)-one, 6-hydroxy-4-methyl-1-benzofuran-3-one, 6-hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one, AKOS BBS-00006159
| Molecular Formula | C9H8O3 |
|---|---|
| Molecular Weight | 164.05 g/mol |
| LogP | 1.27572 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.04735 |
| Heavy Atoms | 12 |
| Complexity | 355.03644 |
Chemical Identifiers
| CAS Number | 21861-32-5 |
|---|---|
| SMILES | CC1=CC(=CC2=C1C(=O)CO2)O |
Product Overview
6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one (CAS 21861-32-5), with molecular formula C9H8O3 and molecular weight 164.05 g/mol. IUPAC: 6-hydroxy-4-methyl-1-benzofuran-3-one.
Chemical Property Profile of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one
Property Insights of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one
The XLogP value of 1.27572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one. With a topological polar surface area (TPSA) of 46.53 Ų, 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one 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 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one?
The CAS number of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one is 21861-32-5.
What is the molecular formula of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one?
The molecular formula of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one is C9H8O3.
What is the molecular weight of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one?
The molecular weight of 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one is 164.05 g/mol.
Where can I buy 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one?
You can request a quote for 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.