6-Acetyl-3-bromobenzo(b)thiophene
TL;DR: 6-Acetyl-3-bromobenzo(b)thiophene (CAS 1423-67-2) is a chemical compound with molecular formula C10H7BrOS and molecular weight 253.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromo-1-benzothiophen-6-yl)ethanone
Also Known As: 6-Acetyl-3-bromobenzo(b)thiophene, 6-Acetyl-3-bromobenzo[b]thiophene, 6-Acetyl-3-bromo-1-benzothiophene, Ethanone, 1-(3-bromobenzo[b]thien-6-yl)-, 1-(3-Bromo-1-benzothien-6-yl)ethanone #
| Molecular Formula | C10H7BrOS |
|---|---|
| Molecular Weight | 253.94 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.9401 |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 1423-67-2 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=C1)C(=CS2)Br |
| InChIKey | VWWQMYCOJHTQGY-UHFFFAOYSA-N |
Product Overview
6-Acetyl-3-bromobenzo(b)thiophene (CAS 1423-67-2), with molecular formula C10H7BrOS and molecular weight 253.94 g/mol. IUPAC: 1-(3-bromo-1-benzothiophen-6-yl)ethanone.
Chemical Property Profile of 6-Acetyl-3-bromobenzo(b)thiophene
Property Insights of 6-Acetyl-3-bromobenzo(b)thiophene
The XLogP value of 3.3 indicates that 6-Acetyl-3-bromobenzo(b)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 6-Acetyl-3-bromobenzo(b)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Acetyl-3-bromobenzo(b)thiophene has 0 hydrogen bond donor(s) and 2 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-Acetyl-3-bromobenzo(b)thiophene?
The CAS number of 6-Acetyl-3-bromobenzo(b)thiophene is 1423-67-2.
What is the molecular formula of 6-Acetyl-3-bromobenzo(b)thiophene?
The molecular formula of 6-Acetyl-3-bromobenzo(b)thiophene is C10H7BrOS.
What is the molecular weight of 6-Acetyl-3-bromobenzo(b)thiophene?
The molecular weight of 6-Acetyl-3-bromobenzo(b)thiophene is 253.94 g/mol.
Where can I buy 6-Acetyl-3-bromobenzo(b)thiophene?
You can request a quote for 6-Acetyl-3-bromobenzo(b)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Acetyl-3-bromobenzo(b)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 6-Acetyl-3-bromobenzo(b)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.