1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-
TL;DR: 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- (CAS 61052-37-7) is a chemical compound with molecular formula C10H10O5 and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-4,6-dimethoxy-3H-2-benzofuran-1-one
Also Known As: 4,6-Dimethoxy-5-hydroxyphthalide, 4,6-Dwumetoksy-5-hydroksyftalid, 4,6-Dwumetoksy-5-hydroksyftalid [Polish], 5-hydroxy-4,6-dimethoxyphthalide, 4,6-Dimethoxy-5-hydroxy-1(3H)-isobenzofuranone
| Molecular Formula | C10H10O5 |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.05283 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 61052-37-7 |
|---|---|
| SMILES | COC1=C(C(=C2COC(=O)C2=C1)OC)O |
| InChIKey | NUCLOIKHTIHRMG-UHFFFAOYSA-N |
Product Overview
1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- (CAS 61052-37-7), with molecular formula C10H10O5 and molecular weight 210.05 g/mol. IUPAC: 5-hydroxy-4,6-dimethoxy-3H-2-benzofuran-1-one.
Chemical Property Profile of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-
Property Insights of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- has 1 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(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-?
The CAS number of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- is 61052-37-7.
What is the molecular formula of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-?
The molecular formula of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- is C10H10O5.
What is the molecular weight of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-?
The molecular weight of 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- is 210.05 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-?
You can request a quote for 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 1(3H)-Isobenzofuranone, 4,6-dimethoxy-5-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.