1178884-68-8 | 6-tert-Butyl-3,4-dihydroisoquinolin-1(2h)-one

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$83.00	$59.00
250mg	98%	in stock	$110.00	$77.00
1g	98%	in stock	$350.00	$245.00

Description

• Catalog Number: AE27094
• Chemical Name: 6-tert-Butyl-3,4-dihydroisoquinolin-1(2h)-one
• CAS Number: 1178884-68-8
• Molecular Formula: C13H17NO
• Molecular Weight: 203.28017999999997
• MDL Number: MFCD19441516
• SMILES: O=C1NCCc2c1ccc(c2)C(C)(C)C

Computed Properties

• Complexity: 254
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2.9

Upstream Synthesis Route

6-tert-Butyl-3,4-dihydroisoquinolin-1(2H)-one, often referred to as $name$, is commonly utilized in chemical synthesis as a versatile building block in the creation of various organic compounds. Its unique structure and reactivity make it valuable in the development of new molecules with potential applications in pharmaceuticals, agrochemicals, and materials science. This compound serves as a key intermediate in the synthesis of complex heterocyclic compounds, allowing chemists to access diverse chemical space and explore novel structures. By incorporating $name$ into synthetic routes, researchers can access a wide range of derivatives and analogs, enabling the discovery of new functional materials and bioactive compounds. In addition, the presence of the tert-butyl group provides steric protection and enhances the compound's stability during reactions, making it an attractive choice for the synthesis of intricate molecular architectures. Overall, the strategic incorporation of 6-tert-Butyl-3,4-dihydroisoquinolin-1(2H)-one in chemical synthesis empowers chemists to construct intricate molecules and explore new frontiers in organic chemistry.