2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane
TL;DR: 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane (CAS 6297-80-9) is a chemical compound with molecular formula C12H14Cl2O2 and molecular weight 260.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dichlorophenyl)-5,5-dimethyl-1,3-dioxane
Also Known As: 2-(2,4-dichlorophenyl)-5,5-dimethyl-1,3-dioxane, 1-[4-(butan-2-yl)phenoxy]propan-2-yl 2-methylpropanoate, RefChem:250129
| Molecular Formula | C12H14Cl2O2 |
|---|---|
| Molecular Weight | 260.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.03708 |
| Heavy Atoms | 16 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 6297-80-9 |
|---|---|
| SMILES | CC1(COC(OC1)C2=C(C=C(C=C2)Cl)Cl)C |
| InChIKey | WUXKVKLALVHUJI-UHFFFAOYSA-N |
Product Overview
2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane (CAS 6297-80-9), with molecular formula C12H14Cl2O2 and molecular weight 260.04 g/mol. IUPAC: 2-(2,4-dichlorophenyl)-5,5-dimethyl-1,3-dioxane.
Chemical Property Profile of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane
Property Insights of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane
The XLogP value of 3.8 indicates that 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane 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 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane?
The CAS number of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane is 6297-80-9.
What is the molecular formula of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane?
The molecular formula of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane is C12H14Cl2O2.
What is the molecular weight of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane?
The molecular weight of 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane is 260.04 g/mol.
Where can I buy 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane?
You can request a quote for 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dichlorophenyl)-5,5-dimethyl-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.