4-nitro-2-phenyl-2H-benzotriazole
TL;DR: 4-nitro-2-phenyl-2H-benzotriazole (CAS 31706-24-8) 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.
4-nitro-2-phenylbenzotriazole
Also Known As: 4-nitro-2-phenyl-2H-benzotriazole, 4-nitro-2-phenylbenzotriazole, 4-nitro-2-phenyl-benzotriazole
| 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 | 721.28046 |
Chemical Identifiers
| CAS Number | 31706-24-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=C3C=CC=C(C3=N2)[N+](=O)[O-] |
Product Overview
4-nitro-2-phenyl-2H-benzotriazole (CAS 31706-24-8), with molecular formula C12H8N4O2 and molecular weight 240.06 g/mol. IUPAC: 4-nitro-2-phenylbenzotriazole.
Chemical Property Profile of 4-nitro-2-phenyl-2H-benzotriazole
Property Insights of 4-nitro-2-phenyl-2H-benzotriazole
The XLogP value of 2.3287 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-2-phenyl-2H-benzotriazole. The TPSA of 73.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-2-phenyl-2H-benzotriazole. Following Lipinski's Rule of Five, 4-nitro-2-phenyl-2H-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 4-nitro-2-phenyl-2H-benzotriazole?
The CAS number of 4-nitro-2-phenyl-2H-benzotriazole is 31706-24-8.
What is the molecular formula of 4-nitro-2-phenyl-2H-benzotriazole?
The molecular formula of 4-nitro-2-phenyl-2H-benzotriazole is C12H8N4O2.
What is the molecular weight of 4-nitro-2-phenyl-2H-benzotriazole?
The molecular weight of 4-nitro-2-phenyl-2H-benzotriazole is 240.06 g/mol.
Where can I buy 4-nitro-2-phenyl-2H-benzotriazole?
You can request a quote for 4-nitro-2-phenyl-2H-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-2-phenyl-2H-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-2-phenyl-2H-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.