2-Benzyl-1,3-dioxolane
TL;DR: 2-Benzyl-1,3-dioxolane (CAS 101-49-5) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzyl-1,3-dioxolane
Also Known As: 2-Benzyl-1,3-dioxolane, 2-Benzyldioxolan, benzyldioxolan, 1,3-Dioxolane, 2-(phenylmethyl)-, Phenylacetaldehyde ethylene acetal
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.08372 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.08372 Da |
| Heavy Atoms | 12 |
| Complexity | 124.0 |
| SMILES | C1COC(O1)CC2=CC=CC=C2 |
| InChIKey | SSZACLYPEFCREM-UHFFFAOYSA-N |
Product Description
Applications: 2-Benzyl-1,3-dioxolane is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Benzyl-1,3-dioxolane (CAS 101-49-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2-Benzyl-1,3-dioxolane is a pharmaceutical intermediate identified by CAS number 101-49-5 and the molecular formula C10H12O2 and a molecular weight of 164.08 g/mol. It is also known as 2-Benzyl-1,3-dioxolane and 2-Benzyldioxolan.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Benzyl-1,3-dioxolane
Property Insights of 2-Benzyl-1,3-dioxolane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzyl-1,3-dioxolane. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Benzyl-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-1,3-dioxolane 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 2-Benzyl-1,3-dioxolane?
The CAS number of 2-Benzyl-1,3-dioxolane is 101-49-5.
What is the molecular formula of 2-Benzyl-1,3-dioxolane?
The molecular formula of 2-Benzyl-1,3-dioxolane is C10H12O2.
What is the molecular weight of 2-Benzyl-1,3-dioxolane?
The molecular weight of 2-Benzyl-1,3-dioxolane is 164.08372 g/mol.
What are the applications of 2-Benzyl-1,3-dioxolane?
2-Benzyl-1,3-dioxolane is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Benzyl-1,3-dioxolane (CAS...
Where can I buy 2-Benzyl-1,3-dioxolane?
You can request a quote for 2-Benzyl-1,3-dioxolane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Benzyl-1,3-dioxolane?
Yes, CoreyChem provides custom synthesis services for 2-Benzyl-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.