5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane
TL;DR: 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane (CAS 31053-74-4) is a chemical compound with molecular formula C16H18O2 and molecular weight 242.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-2-naphthalen-2-yl-1,3-dioxane
Also Known As: 2-(2-Naphthyl)-5,5-dimethyl-1,3-dioxane, 5,5-dimethyl-2-naphthalen-2-yl-1,3-dioxane, J3.039.060A, 5,5-DIMETHYL-2-(NAPHTHALEN-2-YL)-1,3-DIOXANE
| Molecular Formula | C16H18O2 |
|---|---|
| Molecular Weight | 242.13 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 | 242.13068 |
| Heavy Atoms | 18 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 31053-74-4 |
|---|---|
| SMILES | CC1(COC(OC1)C2=CC3=CC=CC=C3C=C2)C |
| InChIKey | VNCZFSRBHSFJED-UHFFFAOYSA-N |
Product Overview
5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane (CAS 31053-74-4), with molecular formula C16H18O2 and molecular weight 242.13 g/mol. IUPAC: 5,5-dimethyl-2-naphthalen-2-yl-1,3-dioxane.
Chemical Property Profile of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane
Property Insights of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane
The XLogP value of 3.8 indicates that 5,5-Dimethyl-2-(naphthalen-2-YL)-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, 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-2-(naphthalen-2-YL)-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 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane?
The CAS number of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane is 31053-74-4.
What is the molecular formula of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane?
The molecular formula of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane is C16H18O2.
What is the molecular weight of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane?
The molecular weight of 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane is 242.13 g/mol.
Where can I buy 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane?
You can request a quote for 5,5-Dimethyl-2-(naphthalen-2-YL)-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 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-2-(naphthalen-2-YL)-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.