6-(2,2-Dichlorovinyl)-4-methylpyran-2-one
TL;DR: 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one (CAS 64254-07-5) is a chemical compound with molecular formula C8H6Cl2O2 and molecular weight 203.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,2-dichloroethenyl)-4-methylpyran-2-one
Also Known As: 6-(2,2-dichlorovinyl)-4-methylpyran-2-one, 6-(2,2-dichloroethenyl)-4-methylpyran-2-one, 2H-Pyran-2-one, 6-(2,2-dichloroethenyl)-4-methyl-, 6-(2,2-Dichloroethen-1-yl)-4-methyl-2H-pyran-2-one, 7,7-dichloro-5-hydroxy-3-methyl-hepta-2c,4t,6-trienoic acid-lactone
| Molecular Formula | C8H6Cl2O2 |
|---|---|
| Molecular Weight | 203.97 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.97449 |
| Heavy Atoms | 12 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 64254-07-5 |
|---|---|
| SMILES | CC1=CC(=O)OC(=C1)C=C(Cl)Cl |
| InChIKey | CUFQFWNJOPUEAC-UHFFFAOYSA-N |
Product Overview
6-(2,2-Dichlorovinyl)-4-methylpyran-2-one (CAS 64254-07-5), with molecular formula C8H6Cl2O2 and molecular weight 203.97 g/mol. IUPAC: 6-(2,2-dichloroethenyl)-4-methylpyran-2-one.
Chemical Property Profile of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one
Property Insights of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one 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 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one?
The CAS number of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one is 64254-07-5.
What is the molecular formula of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one?
The molecular formula of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one is C8H6Cl2O2.
What is the molecular weight of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one?
The molecular weight of 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one is 203.97 g/mol.
Where can I buy 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one?
You can request a quote for 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(2,2-Dichlorovinyl)-4-methylpyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.