1159982-27-0 | 2-(1-Boc-3-Piperidinylidene)acetonitrile

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	2 weeks	$518.00	$363.00
5g	95%	2 weeks	$1,411.00	$988.00
10g	95%	2 weeks	$2,081.00	$1,457.00
25g	95%	2 weeks	$3,822.00	$2,675.00

Description

• Catalog Number: AA22383
• Chemical Name: 2-(1-Boc-3-Piperidinylidene)acetonitrile
• CAS Number: 1159982-27-0
• Molecular Formula: C12H18N2O2
• Molecular Weight: 222.2835
• MDL Number: MFCD09953299
• SMILES: N#CC=C1CCCN(C1)C(=O)OC(C)(C)C

Computed Properties

• Complexity: 344
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Undefined Bond Stereocenter Count: 1
• XLogP3: 1.1

Upstream Synthesis Route

Tert-Butyl 3-(cyanomethylene)piperidine-1-carboxylate is a versatile compound widely used in chemical synthesis. This particular compound serves as a valuable building block in the creation of various pharmaceutical and agrochemical products. Through its reactive cyanomethylene group, this compound can participate in a range of synthetic transformations, enabling the introduction of functional groups into complex molecular structures. Additionally, the presence of the piperidine ring further enhances the compound's utility in medicinal chemistry by providing a platform for the design of bioactive molecules. In the realm of chemical synthesis, tert-Butyl 3-(cyanomethylene)piperidine-1-carboxylate is a prized component for the construction of diverse organic compounds with potential applications in drug discovery and material science.