Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-
TL;DR: Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- (CAS 56746-02-2) is a chemical compound with molecular formula C8H7N5O2 and molecular weight 205.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-nitro-2H-triazol-4-yl)aniline
Also Known As: Salicylamide, N-(1-(ethylcarbamoyl)ethyl)-, 4-(5-nitro-2H-triazol-4-yl)aniline, N-(4-hydrazinylphenyl)acetamide hydrochloride, 4-(5-NITRO-2H-1,2,3-TRIAZOL-4-YL)ANILINE, Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-
| Molecular Formula | C8H7N5O2 |
|---|---|
| Molecular Weight | 205.06 g/mol |
| LogP | 0.9621 |
| Topological Polar Surface Area | 110.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.05997 |
| Heavy Atoms | 15 |
| Complexity | 489.98807 |
Chemical Identifiers
| CAS Number | 56746-02-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NNN=C2[N+](=O)[O-])N |
Product Overview
Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- (CAS 56746-02-2), with molecular formula C8H7N5O2 and molecular weight 205.06 g/mol. IUPAC: 4-(5-nitro-2H-triazol-4-yl)aniline.
Chemical Property Profile of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-
Property Insights of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-
The XLogP value of 0.9621 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-. The TPSA of 110.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-. Following Lipinski's Rule of Five, Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- has 2 hydrogen bond donor(s) and 5 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 Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-?
The CAS number of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- is 56746-02-2.
What is the molecular formula of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-?
The molecular formula of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- is C8H7N5O2.
What is the molecular weight of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-?
The molecular weight of Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- is 205.06 g/mol.
Where can I buy Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-?
You can request a quote for Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 4-(5-nitro-2H-1,2,3-triazol-4-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.