Benzo(b)thiophene, 3-bromo-
TL;DR: Benzo(b)thiophene, 3-bromo- (CAS 7342-82-7) is a chemical compound with molecular formula C8H5BrS and molecular weight 211.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-1-benzothiophene
Also Known As: 3-Bromobenzo[b]thiophene, 3-Bromo-1-benzothiophene, 3-Bromobenzothiophene, 3-Bromothianaphthene, 3-Bromo-benzo[b]thiophene
| Molecular Formula | C8H5BrS |
|---|---|
| Molecular Weight | 211.93 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.92953 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 7342-82-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CS2)Br |
| InChIKey | SRWDQSRTOOMPMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzo(b)thiophene, 3-bromo- (CAS 7342-82-7), with molecular formula C8H5BrS and molecular weight 211.93 g/mol. IUPAC: 3-bromo-1-benzothiophene.
Chemical Property Profile of Benzo(b)thiophene, 3-bromo-
Property Insights of Benzo(b)thiophene, 3-bromo-
The XLogP value of 3.8 indicates that Benzo(b)thiophene, 3-bromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Benzo(b)thiophene, 3-bromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene, 3-bromo- has 0 hydrogen bond donor(s) and 1 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 Benzo(b)thiophene, 3-bromo-?
The CAS number of Benzo(b)thiophene, 3-bromo- is 7342-82-7.
What is the molecular formula of Benzo(b)thiophene, 3-bromo-?
The molecular formula of Benzo(b)thiophene, 3-bromo- is C8H5BrS.
What is the molecular weight of Benzo(b)thiophene, 3-bromo-?
The molecular weight of Benzo(b)thiophene, 3-bromo- is 211.93 g/mol.
Where can I buy Benzo(b)thiophene, 3-bromo-?
You can request a quote for Benzo(b)thiophene, 3-bromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)thiophene, 3-bromo-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophene, 3-bromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.