5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
TL;DR: 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS 83081-75-8) is a chemical compound with molecular formula C14H12Cl2O4 and molecular weight 314.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,6-dichloro-4-methylphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Also Known As: 5-(2,6-dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione, 5-[(2,6-dichloro-4-methylphenyl)methylidene]-2,2-dimethyl-1,, 5-[(2,6-dichloro-4-methylphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
| Molecular Formula | C14H12Cl2O4 |
|---|---|
| Molecular Weight | 314.01 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.01126 |
| Heavy Atoms | 20 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 83081-75-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)Cl)C=C2C(=O)OC(OC2=O)(C)C)Cl |
| InChIKey | MWYVRLNCGYFEFX-UHFFFAOYSA-N |
Product Overview
5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS 83081-75-8), with molecular formula C14H12Cl2O4 and molecular weight 314.01 g/mol. IUPAC: 5-[(2,6-dichloro-4-methylphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione.
Chemical Property Profile of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
Property Insights of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
The XLogP value of 4.4 indicates that 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione has 0 hydrogen bond donor(s) and 4 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 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione?
The CAS number of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione is 83081-75-8.
What is the molecular formula of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione?
The molecular formula of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione is C14H12Cl2O4.
What is the molecular weight of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione?
The molecular weight of 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione is 314.01 g/mol.
Where can I buy 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione?
You can request a quote for 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,6-Dichloro-4-methylbenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.