3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride
TL;DR: 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride (CAS 34576-83-5) is a chemical compound with molecular formula C9H3Cl2FOS and molecular weight 247.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-fluoro-1-benzothiophene-2-carbonyl chloride
Also Known As: 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride, Butirosina, 3-chloro-6-fluoro-1-benzothiophene-2-carbonyl chloride, 3-chloro-6-fluorobenzothiophene-2-carbonyl chloride, 3-chloro-6-fluorobenzo[b]thiophene-2-carbonylchloride
| Molecular Formula | C9H3Cl2FOS |
|---|---|
| Molecular Weight | 247.93 g/mol |
| LogP | 4.0728 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.92657 |
| Heavy Atoms | 14 |
| Complexity | 520.75146 |
Chemical Identifiers
| CAS Number | 34576-83-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)Cl |
Product Overview
3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride (CAS 34576-83-5), with molecular formula C9H3Cl2FOS and molecular weight 247.93 g/mol. IUPAC: 3-chloro-6-fluoro-1-benzothiophene-2-carbonyl chloride.
Chemical Property Profile of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride
Property Insights of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride
The XLogP value of 4.0728 indicates that 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride 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 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride?
The CAS number of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride is 34576-83-5.
What is the molecular formula of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride?
The molecular formula of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride is C9H3Cl2FOS.
What is the molecular weight of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride?
The molecular weight of 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride is 247.93 g/mol.
Where can I buy 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride?
You can request a quote for 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.