3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole
TL;DR: 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole (CAS 132784-60-2) is a chemical compound with molecular formula C11H7Cl2NO and molecular weight 238.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-dichloroethenyl)-5-phenyl-1,2-oxazole
Also Known As: 3-(2,2-dichlorovinyl)-5-phenylisoxazole, 3-(2,2-dichloroethenyl)-5-phenyl-1,2-oxazole, 3-(2,2-dichloro-vinyl)-5-phenyl-isoxazole, A0031/0001410, 683-508-0
| Molecular Formula | C11H7Cl2NO |
|---|---|
| Molecular Weight | 238.99 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.99046 |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 132784-60-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=NO2)C=C(Cl)Cl |
| InChIKey | UHKQVZNOJCRPQW-UHFFFAOYSA-N |
Product Overview
3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole (CAS 132784-60-2), with molecular formula C11H7Cl2NO and molecular weight 238.99 g/mol. IUPAC: 3-(2,2-dichloroethenyl)-5-phenyl-1,2-oxazole.
Chemical Property Profile of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole
Property Insights of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole
The XLogP value of 4.0 indicates that 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole 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-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole?
The CAS number of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole is 132784-60-2.
What is the molecular formula of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole?
The molecular formula of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole is C11H7Cl2NO.
What is the molecular weight of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole?
The molecular weight of 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole is 238.99 g/mol.
Where can I buy 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole?
You can request a quote for 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,2-Dichloro-vinyl)-5-phenyl-isoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.