1001-53-2 | N-Acetylethylenediamine

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$13.00	$9.00
5g	95%	in stock	$21.00	$15.00
10g	95%	in stock	$33.00	$23.00
25g	95%	in stock	$71.00	$50.00
500g	95%	in stock	$1,381.00	$967.00

Description

• Catalog Number: AA01028
• Chemical Name: N-Acetylethylenediamine
• CAS Number: 1001-53-2
• Molecular Formula: C4H10N2O
• Molecular Weight: 102.135
• MDL Number: MFCD00008163
• SMILES: CC(=O)NCCN
• NSC Number: 28936

Computed Properties

• Complexity: 62.7
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 7
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• XLogP3: -1.4

Upstream Synthesis Route

N-Acetylethylenediamine is a versatile compound widely utilized in chemical synthesis as a crucial building block. Its primary application lies in the creation of advanced organic compounds through various reactions and transformations. With its reactive amino and acetyl groups, N-Acetylethylenediamine serves as a key intermediate in the production of pharmaceuticals, agrochemicals, and specialty chemicals.In chemical synthesis, N-Acetylethylenediamine plays a significant role in the formation of complex molecular structures. It can participate in key reactions such as acylation, amidation, and condensation, leading to the development of new compounds with diverse functionalities. Furthermore, its unique chemical properties enable the selective modification of other molecules, allowing for precise control over the final product's structure and properties.Overall, N-Acetylethylenediamine is a valuable tool in the hands of chemists, offering a wide range of possibilities for the synthesis of novel compounds with various applications across industries.

Literature

• Synthesis, structure-activity relationship, and pharmacological studies of novel melanin-concentrating hormone receptor 1 antagonists 3-aminomethylquinolines: reducing human ether-a-go-go-related gene (hERG) associated liabilities.

  Journal of medicinal chemistry 20120510

• Synthesis and chemical characterization of the novel agronomically relevant pentadentate chelate 2-(2-((2-hydroxybenzyl)amino)ethylamino)-2-(2-hydroxyphenyl)acetic acid (DCHA).

  Journal of agricultural and food chemistry 20100714

• N[bond]C(alpha) bond dissociation energies and kinetics in amide and peptide radicals. Is the dissociation a non-ergodic process?

  Journal of the American Chemical Society 20030514