1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole
TL;DR: 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole (CAS 313225-01-3) is a chemical compound with molecular formula C13H8BrN3O and molecular weight 300.98508 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzotriazol-1-yl-(4-bromophenyl)methanone
Also Known As: CBChromo1_000072, 1-(4-bromobenzoyl)-1h-1,2,3-benzotriazole, benzotriazolyl 4-bromophenyl ketone, 1-(4-Bromobenzoyl)-1H-benzotriazole, benzotriazol-1-yl-(4-bromophenyl)methanone
Technical Specifications
| Molecular Formula | C13H8BrN3O |
| Molecular Weight | 300.98508 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.98508 Da |
| Heavy Atoms | 18 |
| Complexity | 317.0 |
| SMILES | C1=CC=C2C(=C1)N=NN2C(=O)C3=CC=C(C=C3)Br |
| InChIKey | HJPNHGVNYCBIIB-UHFFFAOYSA-N |
Product Description
Applications: 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole is used in organic synthesis and process chemistry. 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 fine chemical supplied by CoreyChem, 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole (CAS 313225-01-3) has the molecular formula C13H8BrN3O and a molecular weight of 300.99 g/mol. Synonyms include CBChromo1_000072 and 1-(4-bromobenzoyl)-1h-1,2,3-benzotriazole.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole
Property Insights of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole
The XLogP value of 3.3 indicates that 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.8 Ų, 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole has 0 hydrogen bond donor(s) and 3 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-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole?
The CAS number of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole is 313225-01-3.
What is the molecular formula of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole?
The molecular formula of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole is C13H8BrN3O.
What is the molecular weight of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole?
The molecular weight of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole is 300.98508 g/mol.
What are the applications of 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole?
1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole is used in organic synthesis and process chemistry. 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...
Where can I buy 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole?
You can request a quote for 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole?
Yes, CoreyChem provides custom synthesis services for 1-(4-Bromobenzoyl)-1h-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.