108468-00-4 | 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$11.00	$8.00
5g	97%	in stock	$26.00	$19.00
10g	97%	in stock	$50.00	$35.00
25g	97%	in stock	$123.00	$87.00
100g	97%	in stock	$487.00	$341.00

Description

• Catalog Number: AB52558
• Chemical Name: 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene
• CAS Number: 108468-00-4
• Molecular Formula: C13H20N2O2
• Molecular Weight: 236.3101
• MDL Number: MFCD02683058
• SMILES: NCc1ccc(cc1)CNC(=O)OC(C)(C)C

Computed Properties

• Complexity: 240
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 17
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 5
• XLogP3: 1.3

Upstream Synthesis Route

The compound 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene, also known as $name$, is a valuable reagent in chemical synthesis due to its versatile applications. As a bifunctional compound, it serves as a building block for the synthesis of various organic molecules. The N-Boc (tert-butoxycarbonyl) protecting group provides stability to the amino group, allowing for selective reactions to be carried out at the other amine functional group. This feature is particularly useful in peptide synthesis, where the selective deprotection of specific amino groups is crucial for controlling the order of bond formation. Additionally, the benzene ring in the molecule offers aromatic properties that can be harnessed for further functionalization through electrophilic aromatic substitution reactions. The presence of two amino groups provides opportunities for cross-coupling reactions to generate complex molecules with multiple points of attachment. Overall, $name$ plays a significant role in the synthesis of structurally diverse compounds with applications in medicinal chemistry, materials science, and other fields of organic chemistry.