1-(2-Bromoethyl)-1H-1,2,3-benzotriazole
TL;DR: 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole (CAS 73006-69-6) is a chemical compound with molecular formula C8H8BrN3 and molecular weight 224.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromoethyl)benzotriazole
Also Known As: 1-(2-bromoethyl)benzotriazole, 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole, 1-(2-Bromoethyl)-1H-benzo[d][1,2,3]triazole
| Molecular Formula | C8H8BrN3 |
|---|---|
| Molecular Weight | 224.99 g/mol |
| LogP | 1.8262 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.99016 |
| Heavy Atoms | 12 |
| Complexity | 382.43835 |
Chemical Identifiers
| CAS Number | 73006-69-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CCBr |
Product Overview
1-(2-Bromoethyl)-1H-1,2,3-benzotriazole (CAS 73006-69-6), with molecular formula C8H8BrN3 and molecular weight 224.99 g/mol. IUPAC: 1-(2-bromoethyl)benzotriazole.
Chemical Property Profile of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole
Property Insights of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole
The XLogP value of 1.8262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole. With a topological polar surface area (TPSA) of 30.71 Ų, 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole 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
Frequently Asked Questions
What is the CAS number of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole?
The CAS number of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole is 73006-69-6.
What is the molecular formula of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole?
The molecular formula of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole is C8H8BrN3.
What is the molecular weight of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole?
The molecular weight of 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole is 224.99 g/mol.
Where can I buy 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole?
You can request a quote for 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromoethyl)-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.