863504-84-1 | tert-Butyl 3-amino-1h-pyrazole-1-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
250mg	96%	in stock	$14.00	$10.00
1g	96%	in stock	$18.00	$13.00
5g	96%	in stock	$80.00	$56.00
25g	96%	in stock	$374.00	$262.00

Description

• Catalog Number: AI57782
• Chemical Name: tert-Butyl 3-amino-1h-pyrazole-1-carboxylate
• CAS Number: 863504-84-1
• Molecular Formula: C8H13N3O2
• Molecular Weight: 183.2077
• MDL Number: MFCD13194910
• SMILES: O=C(n1ccc(n1)N)OC(C)(C)C

Computed Properties

• Complexity: 200
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.2

Upstream Synthesis Route

The tert-Butyl 3-amino-1H-pyrazole-1-carboxylate plays a crucial role in chemical synthesis as a versatile building block with diverse applications. Its unique structure and reactivity make it an invaluable intermediate in the synthesis of various organic compounds. This compound can be utilized in the preparation of pharmaceuticals, agrochemicals, and advanced materials due to its ability to participate in multiple types of chemical reactions, such as nucleophilic substitution, acylation, and condensation reactions. Additionally, tert-Butyl 3-amino-1H-pyrazole-1-carboxylate serves as a key component in the creation of complex organic molecules with tailored properties, making it a highly sought-after compound in the field of organic synthesis.