![1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one structure](/static/products/7056/70565-23-0.webp)
1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one
TL;DR: 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one (CAS 70565-23-0) is a chemical compound with molecular formula C12H9Cl2NO2 and molecular weight 269.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]ethanone
Also Known As: Maybridge1_008743, 1-[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one, 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]ethanone, 1-[3-(2,6-DICHLORO-PHENYL)-5-METHYL-ISOXAZOL-4-YL]-ETHANONE, 1-(3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl)ethanone
| Molecular Formula | C12H9Cl2NO2 |
|---|---|
| Molecular Weight | 269.00 g/mol |
| LogP | 4.15942 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.00104 |
| Heavy Atoms | 17 |
| Complexity | 569.9367 |
Chemical Identifiers
| CAS Number | 70565-23-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)C |
Product Overview
1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one (CAS 70565-23-0), with molecular formula C12H9Cl2NO2 and molecular weight 269.00 g/mol. IUPAC: 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]ethanone.
Chemical Property Profile of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one
Property Insights of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one
The XLogP value of 4.15942 indicates that 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one 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-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one?
The CAS number of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one is 70565-23-0.
What is the molecular formula of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one?
The molecular formula of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one is C12H9Cl2NO2.
What is the molecular weight of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one?
The molecular weight of 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one is 269.00 g/mol.
Where can I buy 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one?
You can request a quote for 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.