1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone
TL;DR: 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone (CAS 50460-05-4) is a chemical compound with molecular formula C8H7ClO2S and molecular weight 201.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetylthiophen-2-yl)-2-chloroethanone
Also Known As: Chloromethyl Thienyl Ketone deriv. 19, 1-(5-acetylthiophen-2-yl)-2-chloroethanone, 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone, 1-(5-acetylthiophen-2-yl)-2-chloroethan-1-one, 1-(5-Acetyl-2-thienyl)-2-chloroethanone
| Molecular Formula | C8H7ClO2S |
|---|---|
| Molecular Weight | 201.99 g/mol |
| LogP | 2.3722 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.98553 |
| Heavy Atoms | 12 |
| Complexity | 316.6127 |
Chemical Identifiers
| CAS Number | 50460-05-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(S1)C(=O)CCl |
Product Overview
1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone (CAS 50460-05-4), with molecular formula C8H7ClO2S and molecular weight 201.99 g/mol. IUPAC: 1-(5-acetylthiophen-2-yl)-2-chloroethanone.
Chemical Property Profile of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone
Property Insights of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone
The XLogP value of 2.3722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone. With a topological polar surface area (TPSA) of 34.14 Ų, 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone 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 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone?
The CAS number of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone is 50460-05-4.
What is the molecular formula of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone?
The molecular formula of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone is C8H7ClO2S.
What is the molecular weight of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone?
The molecular weight of 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone is 201.99 g/mol.
Where can I buy 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone?
You can request a quote for 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Acetyl-thiophen-2-yl)-2-chloro-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.