6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt
TL;DR: 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt (CAS 7120-73-2) is a chemical compound with molecular formula C12H8N4 and molecular weight 208.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzotriazolo[2,1-a]benzotriazol-5-ium-6-ide
Also Known As: Noname, Ex058, Dibenzo-1,3a,4,6a-tetraazapentalene, BAS 00012644, 1,3,5-Triethoxy-2,4,6-trinitrobenzene
| Molecular Formula | C12H8N4 |
|---|---|
| Molecular Weight | 208.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 22.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.07489 |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 7120-73-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)[N-][N+]3=C4C=CC=CC4=NN23 |
| InChIKey | GNYDVCSYVQXVGF-UHFFFAOYSA-N |
Product Overview
6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt (CAS 7120-73-2), with molecular formula C12H8N4 and molecular weight 208.07 g/mol. IUPAC: benzotriazolo[2,1-a]benzotriazol-5-ium-6-ide.
Chemical Property Profile of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt
Property Insights of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt. With a topological polar surface area (TPSA) of 22.4 Ų, 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt 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 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt?
The CAS number of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt is 7120-73-2.
What is the molecular formula of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt?
The molecular formula of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt is C12H8N4.
What is the molecular weight of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt?
The molecular weight of 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt is 208.07 g/mol.
Where can I buy 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt?
You can request a quote for 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt?
Yes, KEHONG BIO provides custom synthesis services for 6h-benzotriazolo(2,1-a)benzotriazol-5-ium, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.