4922-98-9 | 5-Phenyl-4H-1,2,4-triazol-3-amine

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$39.00	$27.00
250mg	98%	in stock	$49.00	$35.00
1g	98%	in stock	$65.00	$45.00
5g	98%	in stock	$298.00	$209.00

Description

• Catalog Number: AB49106
• Chemical Name: 5-Phenyl-4H-1,2,4-triazol-3-amine
• CAS Number: 4922-98-9
• Molecular Formula: C8H8N4
• Molecular Weight: 160.17592
• MDL Number: MFCD00086332
• SMILES: Nc1nnc([nH]1)c1ccccc1

Computed Properties

• Complexity: 144
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 1.5

Upstream Synthesis Route

5-Phenyl-4H-1,2,4-triazol-3-amine is a versatile compound used widely in chemical synthesis, particularly in the development of pharmaceuticals and agrochemicals. Its unique molecular structure makes it a valuable building block for the creation of novel organic molecules with potential bioactive properties. In chemical synthesis, 5-Phenyl-4H-1,2,4-triazol-3-amine can serve as a crucial intermediate in the production of various heterocyclic compounds and complex organic molecules. Its presence can impart specific functionalities and contribute to the overall structure and reactivity of the final compound. Furthermore, the use of 5-Phenyl-4H-1,2,4-triazol-3-amine in chemical synthesis allows for the introduction of phenyl and triazol groups into the target molecules, offering opportunities to modulate their biological activities or physical properties. This compound's versatility and reactivity make it a valuable tool for chemists seeking to design and synthesize new molecules for a range of applications in the pharmaceutical and agricultural industries.

Literature

• N-Carbethoxy-N'-(3-phenyl-1H-1,2,4-triazol-5-yl)thiourea.

  Acta crystallographica. Section E, Structure reports online 20100201

• 3-Phenyl-1H-1,2,4-triazol-5-amine-5-phenyl-1H-1,2,4-triazol-3-amine (1/1).

  Acta crystallographica. Section E, Structure reports online 20090101

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501