Ethanone, 1-(2,4,5-trichloro3-thienyl)-
TL;DR: Ethanone, 1-(2,4,5-trichloro3-thienyl)- (CAS 89284-87-7) is a chemical compound with molecular formula C6H3Cl3OS and molecular weight 227.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4,5-trichlorothiophen-3-yl)ethanone
Also Known As: 1-(2,4,5-trichlorothiophen-3-yl)ethanone, Ethanone, 1-(2,4,5-trichloro3-thienyl)-, 2.3.5-Trichlor-4-acetyl-thiophen, Ketone, methyl 2,4,5-trichloro-3-thienyl, 1-(2,4,5-Trichlorothiophen-3-yl)ethan-1-one
| Molecular Formula | C6H3Cl3OS |
|---|---|
| Molecular Weight | 227.90 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.89702 |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 89284-87-7 |
|---|---|
| SMILES | CC(=O)C1=C(SC(=C1Cl)Cl)Cl |
| InChIKey | IAIAHQFUCALRGH-UHFFFAOYSA-N |
Product Overview
Ethanone, 1-(2,4,5-trichloro3-thienyl)- (CAS 89284-87-7), with molecular formula C6H3Cl3OS and molecular weight 227.90 g/mol. IUPAC: 1-(2,4,5-trichlorothiophen-3-yl)ethanone.
Chemical Property Profile of Ethanone, 1-(2,4,5-trichloro3-thienyl)-
Property Insights of Ethanone, 1-(2,4,5-trichloro3-thienyl)-
The XLogP value of 3.8 indicates that Ethanone, 1-(2,4,5-trichloro3-thienyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, Ethanone, 1-(2,4,5-trichloro3-thienyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(2,4,5-trichloro3-thienyl)- 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 Ethanone, 1-(2,4,5-trichloro3-thienyl)-?
The CAS number of Ethanone, 1-(2,4,5-trichloro3-thienyl)- is 89284-87-7.
What is the molecular formula of Ethanone, 1-(2,4,5-trichloro3-thienyl)-?
The molecular formula of Ethanone, 1-(2,4,5-trichloro3-thienyl)- is C6H3Cl3OS.
What is the molecular weight of Ethanone, 1-(2,4,5-trichloro3-thienyl)-?
The molecular weight of Ethanone, 1-(2,4,5-trichloro3-thienyl)- is 227.90 g/mol.
Where can I buy Ethanone, 1-(2,4,5-trichloro3-thienyl)-?
You can request a quote for Ethanone, 1-(2,4,5-trichloro3-thienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(2,4,5-trichloro3-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(2,4,5-trichloro3-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.