5-Isopropyl-4H-1,2,4-triazol-3-amine

Name: 5-Isopropyl-4H-1,2,4-triazol-3-amine
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 22882-41-3
Cat. No. CS-0154265
Purity≥95%
MDL No.MFCD18796168

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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5-Isopropyl-4H-1,2,4-triazol-3-amine|CS-0154265

Structure of 22882-41-3

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General Information

CAS No. 22882-41-3
Cat. No. CS-0154265
Purity ≥95%
MDL No. MFCD18796168
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₅H₁₀N₄
Molecular Weight 126.16
Synonym(s) 5-propan-2-yl-1H-1,2,4-triazol-3-amine
SMILES NC1=NN=C(C(C)C)N1

Description

5-Isopropyl-4H-1,2,4-triazol-3-amine features a sterically hindered triazole core with a pendant isopropyl group, enhancing solubility and stability. This bench-stable scaffold integrates readily into functional molecules, offering robust anchoring for metal coordination and hydrogen bonding in catalytic and medicinal applications.

Application

5-Isopropyl-4H-1,2,4-triazol-3-amine serves as a versatile heterocyclic building block in medicinal chemistry, enabling the construction of triazolyl scaffolds prevalent in bioactive molecules. Its amine functionality facilitates straightforward derivatization, while the isopropyl group enhances lipophilicity and metabolic stability. The compound exhibits good bench stability and compatibility with standard coupling reactions, making it a practical choice for iterative synthesis campaigns targeting pharmaceutical intermediates.

Synthesis

Route1
- 10308-82-4
- 79-31-2
- ~%
- In-stock
  
  22882-41-3
References
- Journal of the Chemical Society, , p. 1732

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 67.59
LogP 0.5103
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Key Words

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5-Isopropyl-4H-1,2,4-triazol-3-amine

CAS No. 22882-41-3

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