Benzo(b)thiophene-3-ol
TL;DR: Benzo(b)thiophene-3-ol (CAS 520-72-9) is a chemical compound with molecular formula C8H6OS and molecular weight 150.01393 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzothiophen-3-ol
Also Known As: benzo[b]thiophen-3-ol, 3-Hydroxybenzothiophene, 1-Benzothiophen-3-ol, Benzothiophen-3-ol, 3-Hydroxythianaphthene
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H6OS |
| Molecular Weight | 150.01393 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 48.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.01393 Da |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
| SMILES | C1=CC=C2C(=C1)C(=CS2)O |
| InChIKey | XHQBIYCRFVVHFD-UHFFFAOYSA-N |
Product Description
Applications: Benzo(b)thiophene-3-ol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Benzo(b)thiophene-3-ol (CAS 520-72-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Benzo(b)thiophene-3-ol is a heterocyclic building block identified by CAS number 520-72-9 and the molecular formula C8H6OS and a molecular weight of 150.01 g/mol. It is also known as benzo[b]thiophen-3-ol and 3-Hydroxybenzothiophene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Benzo(b)thiophene-3-ol
Property Insights of Benzo(b)thiophene-3-ol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo(b)thiophene-3-ol. With a topological polar surface area (TPSA) of 48.5 Ų, Benzo(b)thiophene-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene-3-ol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzo(b)thiophene-3-ol?
The CAS number of Benzo(b)thiophene-3-ol is 520-72-9.
What is the molecular formula of Benzo(b)thiophene-3-ol?
The molecular formula of Benzo(b)thiophene-3-ol is C8H6OS.
What is the molecular weight of Benzo(b)thiophene-3-ol?
The molecular weight of Benzo(b)thiophene-3-ol is 150.01393 g/mol.
What are the applications of Benzo(b)thiophene-3-ol?
Benzo(b)thiophene-3-ol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Benzo(b)thiophene-3-ol (CAS...
Where can I buy Benzo(b)thiophene-3-ol?
You can request a quote for Benzo(b)thiophene-3-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzo(b)thiophene-3-ol?
Yes, CoreyChem provides custom synthesis services for Benzo(b)thiophene-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.