1-(1-Azidoethyl)-1H-1,2,3-benzotriazole
TL;DR: 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole (CAS 155791-29-0) is a chemical compound with molecular formula C8H8N6 and molecular weight 188.08104 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-azidoethyl)benzotriazole
Also Known As: 1-(1-azidoethyl)benzotriazole, 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole, 1-(1H-Benzotriazol-1-yl)ethyl azide
Technical Specifications
| Molecular Formula | C8H8N6 |
| Molecular Weight | 188.08104 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 45.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.08104 Da |
| Heavy Atoms | 14 |
| Complexity | 248.0 |
| SMILES | CC(N=[N+]=[N-])N1C2=CC=CC=C2N=N1 |
| InChIKey | VYERLAVEQFCLRW-UHFFFAOYSA-N |
Chemical Property Profile of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole
Property Insights of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole. With a topological polar surface area (TPSA) of 45.1 Ų, 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole 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 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole?
The CAS number of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole is 155791-29-0.
What is the molecular formula of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole?
The molecular formula of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole is C8H8N6.
What is the molecular weight of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole?
The molecular weight of 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole is 188.08104 g/mol.
Where can I buy 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole?
You can request a quote for 1-(1-Azidoethyl)-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-(1-Azidoethyl)-1H-1,2,3-benzotriazole?
Yes, CoreyChem provides custom synthesis services for 1-(1-Azidoethyl)-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.