Lot numbers can be found on the outside label of a product:
5-Phenyl-4H-1,2,4-triazol-3-amine
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CAS No. 4922-98-9
- Cat. No. CS-0037015
- Purity≥98%
- MDL No.None
*For research and further manufacturing use only, not for direct human use.
Structure of 4922-98-9
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General Information
- CAS No. 4922-98-9
- Cat. No. CS-0037015
- Purity ≥98%
- MDL No. None
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₈N₄
- Molecular Weight 160.18
- Synonym(s) 5-Phenyl-1H-1,2,4-triazol-3-amine
- SMILES NC(N1)=NN=C1C2=CC=CC=C2
Description
5-Phenyl-4H-1,2,4-triazol-3-amine delivers a robust triazole core with a phenyl substituent at the 5-position, enhancing π-stacking potential and electron delocalization. This bench-stable heterocycle features a primary amine group capable of direct functionalization, enabling integration into bioconjugation workflows and medicinal chemistry scaffolds.
Application
5-Phenyl-4H-1,2,4-triazol-3-amine serves as a versatile heterocyclic building block in medicinal chemistry, enabling rapid access to triazolyl-containing scaffolds via standard coupling and functionalization reactions. Its bench-stable nature and tolerance to diverse reaction conditions facilitate efficient synthesis of bioactive molecules, including kinase inhibitors and antifungal agents.
Synthesis
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Route1
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3679-92-3 - ~%
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In-stock
4922-98-9
References
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Dolzhenko, Anton V.; Dolzhenko, Anna V.; Chui, Wai-Keung Tetrahedron, 2007 , vol. 63, # 52 p. 12888 - 12895
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Route2
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613-94-5 - ~%
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In-stock
4922-98-9
References
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Bera, Hriday; Tan, Bee Jen; Sun, Lingyi; Dolzhenko, Anton V.; Chui, Wai-Keung; Chiu, Gigi Nagar Chee European Journal of Medicinal Chemistry, 2013 , vol. 67, p. 325 - 334
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Route3
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98-88-4
- ~%
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In-stock
4922-98-9
References
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Bera, Hriday; Tan, Bee Jen; Sun, Lingyi; Dolzhenko, Anton V.; Chui, Wai-Keung; Chiu, Gigi Nagar Chee European Journal of Medicinal Chemistry, 2013 , vol. 67, p. 325 - 334
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 67.59
- LogP 1.0539
- H_Acceptors 3
- H_Donors 2
- Rotatable_Bonds 1
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Key Words
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