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5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride
TL;DR: 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride (CAS 338797-11-8) is a chemical compound with molecular formula C9H6BrClO2S2 and molecular weight 323.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-methyl-1-benzothiophene-2-sulfonyl chloride
Also Known As: 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride, 5-Bromo-3-methylbenzo[b]thiophene-2-sulfonyl chloride, 5-bromo-3-methyl-1-benzothiophene-2-sulfonyl chloride, 5-bromo-3-methyl-benzothiophene-2-sulfonyl Chloride, 5-Bromo-2-(chlorosulphonyl)-3-methylbenzo[b]thiophene
| Molecular Formula | C9H6BrClO2S2 |
|---|---|
| Molecular Weight | 323.87 g/mol |
| LogP | 3.89972 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.8681 |
| Heavy Atoms | 15 |
| Complexity | 630.8449 |
Chemical Identifiers
| CAS Number | 338797-11-8 |
|---|---|
| SMILES | CC1=C(SC2=C1C=C(C=C2)Br)S(=O)(=O)Cl |
Product Overview
5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride (CAS 338797-11-8), with molecular formula C9H6BrClO2S2 and molecular weight 323.87 g/mol. IUPAC: 5-bromo-3-methyl-1-benzothiophene-2-sulfonyl chloride.
Chemical Property Profile of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride
Property Insights of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride
The XLogP value of 3.89972 indicates that 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride has 0 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 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride?
The CAS number of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride is 338797-11-8.
What is the molecular formula of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride?
The molecular formula of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride is C9H6BrClO2S2.
What is the molecular weight of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride?
The molecular weight of 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride is 323.87 g/mol.
Where can I buy 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride?
You can request a quote for 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-3-methylbenzo[b]thiophene-2-sulphonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.