102-29-4 | 1,3-Benzenediol, 1-acetate

Packsize	Purity	Availability	Price	Discounted Price
25g	50%	in stock	$25.00	$18.00
100g	50%	in stock	$63.00	$45.00
500g	50%	in stock	$240.00	$168.00

Description

• Catalog Number: AA07897
• Chemical Name: 1,3-Benzenediol, 1-acetate
• CAS Number: 102-29-4
• Molecular Formula: C8H8O3
• Molecular Weight: 152.1473
• MDL Number: MFCD00002266
• SMILES: CC(=O)Oc1cccc(c1)O

Computed Properties

• Complexity: 144
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.3

Upstream Synthesis Route

Resorcinol Monoacetate is a versatile compound widely used in chemical synthesis, particularly in the production of pharmaceuticals, agrochemicals, and fine chemicals. This derivative of resorcinol serves as a crucial building block in the synthesis of various biologically active compounds due to its unique properties and reactivity. Its application in organic synthesis involves the acetylation of the hydroxyl group on the resorcinol ring, leading to the formation of Resorcinol Monoacetate. This intermediate can further partake in condensation reactions, aromatic substitutions, and other transformations to yield complex organic molecules with desired pharmacological or chemical properties. In pharmaceutical research, Resorcinol Monoacetate is utilized in the development of anticancer agents, anti-inflammatory drugs, and antimicrobial compounds. Additionally, it finds significance in the synthesis of dyes, UV stabilizers, and fragrance ingredients. Its broad spectrum of applications underscores its importance in modern chemical research and industrial processes. By leveraging the synthetic potential of Resorcinol Monoacetate, chemists can access a diverse array of functionalized molecules with valuable applications across various sectors.

Literature

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101

• Classification of benzoyl peroxide as safe and effective and revision of labeling to drug facts format; topical acne drug products for over-the-counter human use; final rule.

  Federal register 20100304

• The complete multipartite genome sequence of Cupriavidus necator JMP134, a versatile pollutant degrader.

  PloS one 20100101

• A two-component hydroxylase involved in the assimilation of 3-hydroxyphenyl acetate in Pseudomonas putida.

  The Journal of biological chemistry 20050715