1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-
TL;DR: 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- (CAS 67633-94-7) is a chemical compound with molecular formula C14H20O2 and molecular weight 220.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-4,4,6-trimethyl-1,3-dioxane
Also Known As: Reseda body, reseda acetal, 2-Benzyl-4,4,6-trimethyl-1,3-dioxane, m-Dioxane,4,6-trimethyl-, 4,4,6-Trimethyl-2-benzyl-1,3-dioxane
| Molecular Formula | C14H20O2 |
|---|---|
| Molecular Weight | 220.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.14633 |
| Heavy Atoms | 16 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 67633-94-7 |
|---|---|
| SMILES | CC1CC(OC(O1)CC2=CC=CC=C2)(C)C |
| InChIKey | KSEFBQCEGMTNPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- (CAS 67633-94-7), with molecular formula C14H20O2 and molecular weight 220.15 g/mol. IUPAC: 2-benzyl-4,4,6-trimethyl-1,3-dioxane.
Chemical Property Profile of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-
Property Insights of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-
The XLogP value of 3.2 indicates that 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- 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 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-?
The CAS number of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- is 67633-94-7.
What is the molecular formula of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-?
The molecular formula of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- is C14H20O2.
What is the molecular weight of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-?
The molecular weight of 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- is 220.15 g/mol.
Where can I buy 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-?
You can request a quote for 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.