Dibenz(B,F)(1,4)Oxazepine
TL;DR: Dibenz(B,F)(1,4)Oxazepine (CAS 257-07-8) is a chemical compound with molecular formula C13H9NO and molecular weight 195.06842 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzo[b][1,4]benzoxazepine
Also Known As: Dibenzoxazepine, Dibenz[b,f][1,4]oxazepine, CR (lacrimator), CR gas, Dibenzo[b,f][1,4]oxazepine
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H9NO |
| Molecular Weight | 195.06842 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 195.06842 Da |
| Heavy Atoms | 15 |
| Complexity | 251.0 |
| Melting Point | 73 °C |
| SMILES | C1=CC=C2C(=C1)C=NC3=CC=CC=C3O2 |
| InChIKey | NPUACKRELIJTFM-UHFFFAOYSA-N |
Product Description
Applications: Dibenz(B,F)(1,4)Oxazepine is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. 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).
A heterocyclic building block supplied by CoreyChem, Dibenz(B,F)(1,4)Oxazepine (CAS 257-07-8) has the molecular formula C13H9NO and a molecular weight of 195.07 g/mol. Synonyms include Dibenzoxazepine and Dibenz[b,f][1,4]oxazepine.
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 Dibenz(B,F)(1,4)Oxazepine
Property Insights of Dibenz(B,F)(1,4)Oxazepine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibenz(B,F)(1,4)Oxazepine. With a topological polar surface area (TPSA) of 21.6 Ų, Dibenz(B,F)(1,4)Oxazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenz(B,F)(1,4)Oxazepine 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 Dibenz(B,F)(1,4)Oxazepine?
The CAS number of Dibenz(B,F)(1,4)Oxazepine is 257-07-8.
What is the molecular formula of Dibenz(B,F)(1,4)Oxazepine?
The molecular formula of Dibenz(B,F)(1,4)Oxazepine is C13H9NO.
What is the molecular weight of Dibenz(B,F)(1,4)Oxazepine?
The molecular weight of Dibenz(B,F)(1,4)Oxazepine is 195.06842 g/mol.
What are the applications of Dibenz(B,F)(1,4)Oxazepine?
Dibenz(B,F)(1,4)Oxazepine is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy Dibenz(B,F)(1,4)Oxazepine?
You can request a quote for Dibenz(B,F)(1,4)Oxazepine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dibenz(B,F)(1,4)Oxazepine?
Yes, CoreyChem provides custom synthesis services for Dibenz(B,F)(1,4)Oxazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.