2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate
TL;DR: 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate (CAS 107274-23-7) is a chemical compound with molecular formula C17H18O5S and molecular weight 334.0875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-phenyl-1,3-dioxan-5-yl) 4-methylbenzenesulfonate
Also Known As: BAS 00084399, 2-Phenyl-5-(tosyloxy)-1,3-dioxane, 2alpha-Phenyl-5alpha-(tosyloxy)-1,3-dioxane, J1.300.242H, J2.527.117C
Technical Specifications
| Molecular Formula | C17H18O5S |
| Molecular Weight | 334.0875 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.0875 Da |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2COC(OC2)C3=CC=CC=C3 |
| InChIKey | CTEIQEFIWKXRFK-UHFFFAOYSA-N |
Chemical Property Profile of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate
Property Insights of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate?
The CAS number of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate is 107274-23-7.
What is the molecular formula of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate?
The molecular formula of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate is C17H18O5S.
What is the molecular weight of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate?
The molecular weight of 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate is 334.0875 g/mol.
Where can I buy 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate?
You can request a quote for 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate?
Yes, CoreyChem provides custom synthesis services for 2-Phenyl-1,3-dioxan-5-yl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.