5-Bromo-5-Nitro-1,3-Dioxane
TL;DR: 5-Bromo-5-Nitro-1,3-Dioxane (CAS 30007-47-7) is a chemical compound with molecular formula C4H6BrNO4 and molecular weight 210.94801 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-5-nitro-1,3-dioxane
Also Known As: 5-Bromo-5-nitro-1,3-dioxane, Bronidox, 1,3-Dioxane, 5-bromo-5-nitro-, m-Dioxane, 5-Bromo-5-nitro-m-dioxane
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6BrNO4 |
| Molecular Weight | 210.94801 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 64.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.94801 Da |
| Heavy Atoms | 10 |
| Complexity | 139.0 |
| SMILES | C1C(COCO1)([N+](=O)[O-])Br |
| InChIKey | XVBRCOKDZVQYAY-UHFFFAOYSA-N |
Product Description
Applications: 5-Bromo-5-Nitro-1,3-Dioxane is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
5-Bromo-5-Nitro-1,3-Dioxane is a pharmaceutical intermediate identified by CAS number 30007-47-7 and the molecular formula C4H6BrNO4 and a molecular weight of 210.95 g/mol. Synonyms include 5-Bromo-5-nitro-1,3-dioxane and Bronidox.
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 5-Bromo-5-Nitro-1,3-Dioxane
Property Insights of 5-Bromo-5-Nitro-1,3-Dioxane
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-5-Nitro-1,3-Dioxane. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-5-Nitro-1,3-Dioxane. Following Lipinski's Rule of Five, 5-Bromo-5-Nitro-1,3-Dioxane has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Bromo-5-Nitro-1,3-Dioxane?
The CAS number of 5-Bromo-5-Nitro-1,3-Dioxane is 30007-47-7.
What is the molecular formula of 5-Bromo-5-Nitro-1,3-Dioxane?
The molecular formula of 5-Bromo-5-Nitro-1,3-Dioxane is C4H6BrNO4.
What is the molecular weight of 5-Bromo-5-Nitro-1,3-Dioxane?
The molecular weight of 5-Bromo-5-Nitro-1,3-Dioxane is 210.94801 g/mol.
What are the applications of 5-Bromo-5-Nitro-1,3-Dioxane?
5-Bromo-5-Nitro-1,3-Dioxane is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to...
Where can I buy 5-Bromo-5-Nitro-1,3-Dioxane?
You can request a quote for 5-Bromo-5-Nitro-1,3-Dioxane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Bromo-5-Nitro-1,3-Dioxane?
Yes, CoreyChem provides custom synthesis services for 5-Bromo-5-Nitro-1,3-Dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.