1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-
TL;DR: 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- (CAS 69921-20-6) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,5-trimethyl-5-phenyl-1,3-dioxane
Also Known As: 2,2,5-Trimethyl-5-phenyl-1,3-dioxane, 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-, 2,2-Dimethyl-5-methyl-5-phenyl-1,3-dioxane, 1,3-Dioxane,2,2,5-trimethyl-5-phenyl-, 274-216-0
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H18O2 |
| Molecular Weight | 206.13068 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.13068 Da |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
| SMILES | CC1(OCC(CO1)(C)C2=CC=CC=C2)C |
| InChIKey | GAGMMTUVMITPBL-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-
Property Insights of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- 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
What is the CAS number of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-?
The CAS number of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- is 69921-20-6.
What is the molecular formula of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-?
The molecular formula of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- is C13H18O2.
What is the molecular weight of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-?
The molecular weight of 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- is 206.13068 g/mol.
Where can I buy 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-?
You can request a quote for 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl-?
Yes, CoreyChem provides custom synthesis services for 1,3-Dioxane, 2,2,5-trimethyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.