6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-
TL;DR: 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- (CAS 189264-47-9) is a chemical compound with molecular formula C8H10O3 and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a-hydroxy-2,3,7,7a-tetrahydro-1-benzofuran-6-one
Also Known As: Halleridone, Cleroindicin F, 3a-hydroxy-2,3,7,7a-tetrahydro-1-benzofuran-6-one, 3,3a,7,7a-Tetrahydro-3a-hydroxybenzofuran-6(2H)-one, 3a-Hydroxy-2,3,3a,7a-tetrahydro-6(7H)-benzofuranone
| Molecular Formula | C8H10O3 |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.06299 |
| Heavy Atoms | 11 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 189264-47-9 |
|---|---|
| SMILES | C1COC2C1(C=CC(=O)C2)O |
| InChIKey | HSGPAWIMHOPPDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- (CAS 189264-47-9), with molecular formula C8H10O3 and molecular weight 154.06 g/mol. IUPAC: 3a-hydroxy-2,3,7,7a-tetrahydro-1-benzofuran-6-one.
Chemical Property Profile of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-
Property Insights of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-
The XLogP value of -0.7 indicates that 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- 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(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-?
The CAS number of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- is 189264-47-9.
What is the molecular formula of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-?
The molecular formula of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- is C8H10O3.
What is the molecular weight of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-?
The molecular weight of 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- is 154.06 g/mol.
Where can I buy 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-?
You can request a quote for 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 6(2H)-Benzofuranone, 3,3a,7,7a-tetrahydro-3a-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.