1-(2-Nitrophenyl)benzotriazole
TL;DR: 1-(2-Nitrophenyl)benzotriazole (CAS 2229-36-9) is a chemical compound with molecular formula C12H8N4O2 and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-nitrophenyl)benzotriazole
Also Known As: 1-(2-nitrophenyl)benzotriazole, 1-(2-nitrophenyl)-1H-benzo[d][1,2,3]triazole
| Molecular Formula | C12H8N4O2 |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 2.3287 |
| Topological Polar Surface Area | 73.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.06473 |
| Heavy Atoms | 18 |
| Complexity | 735.53046 |
Chemical Identifiers
| CAS Number | 2229-36-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
1-(2-Nitrophenyl)benzotriazole (CAS 2229-36-9), with molecular formula C12H8N4O2 and molecular weight 240.06 g/mol. IUPAC: 1-(2-nitrophenyl)benzotriazole.
Chemical Property Profile of 1-(2-Nitrophenyl)benzotriazole
Property Insights of 1-(2-Nitrophenyl)benzotriazole
The XLogP value of 2.3287 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Nitrophenyl)benzotriazole. The TPSA of 73.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Nitrophenyl)benzotriazole. Following Lipinski's Rule of Five, 1-(2-Nitrophenyl)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
Frequently Asked Questions
What is the CAS number of 1-(2-Nitrophenyl)benzotriazole?
The CAS number of 1-(2-Nitrophenyl)benzotriazole is 2229-36-9.
What is the molecular formula of 1-(2-Nitrophenyl)benzotriazole?
The molecular formula of 1-(2-Nitrophenyl)benzotriazole is C12H8N4O2.
What is the molecular weight of 1-(2-Nitrophenyl)benzotriazole?
The molecular weight of 1-(2-Nitrophenyl)benzotriazole is 240.06 g/mol.
Where can I buy 1-(2-Nitrophenyl)benzotriazole?
You can request a quote for 1-(2-Nitrophenyl)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-Nitrophenyl)benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Nitrophenyl)benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.