1205-91-0 | 1,4-DIACETOXYBENZENE

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$14.00	$10.00
25g	98%	in stock	$29.00	$21.00
100g	98%	in stock	$62.00	$43.00
500g	98%	in stock	$284.00	$199.00

Description

• Catalog Number: AB54044
• Chemical Name: 1,4-DIACETOXYBENZENE
• CAS Number: 1205-91-0
• Molecular Formula: C10H10O4
• Molecular Weight: 194.184
• MDL Number: MFCD00011643
• SMILES: CC(=O)Oc1ccc(cc1)OC(=O)C
• NSC Number: 9277

Computed Properties

• Complexity: 192
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• XLogP3: 1.3

Upstream Synthesis Route

In chemical synthesis, 1,4-Phenylene diacetate plays a crucial role as a versatile building block for producing various organic compounds. This compound is commonly utilized as a key intermediate in the synthesis of polymers, pharmaceuticals, and fine chemicals. Due to its chemical structure consisting of a phenylene ring linked to two acetate groups, 1,4-Phenylene diacetate serves as a valuable starting material for creating complex molecules through controlled chemical reactions.The presence of functional groups such as acetate moieties in 1,4-Phenylene diacetate enables chemists to introduce specific chemical modifications at desired positions, leading to the formation of tailored compounds with unique properties. By utilizing this compound in chemical reactions, researchers can efficiently construct a wide range of organic structures with precise control over their composition and arrangement. Additionally, the reactivity and stability of 1,4-Phenylene diacetate make it a valuable component in the development of advanced materials and molecular entities for various industrial applications.

Literature

• Poly[[μ2-1,3-bis(pyridin-4-yl)propane](μ3-1,4-phenylenediacetato)cadmium].

  Acta crystallographica. Section C, Crystal structure communications 20120201

• catena-Poly[[(triaqua-cadmium)-μ-1,4-phenyl-enediacetato-κO,O':O'',O'''] dihydrate].

  Acta crystallographica. Section E, Structure reports online 20111201

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

  Bioorganic & medicinal chemistry letters 20101101

• Highly luminescent and triboluminescent coordination polymers assembled from lanthanide β-diketonates and aromatic bidentate O-donor ligands.

  Inorganic chemistry 20101018

• 4,4'-Bipyridinium 1,4-phenyl-ene-diacetate.

  Acta crystallographica. Section E, Structure reports online 20091001

• A novel nickel(II) coordination polymer incorporating 1,4-phenylenediacetic acid and 1,10-phenanthroline.

  Acta crystallographica. Section C, Crystal structure communications 20060201

• A new chain-like cadmium(II) coordination polymer containing chains of water molecules.

  Acta crystallographica. Section C, Crystal structure communications 20050601

• Connecting pairs of dimetal units to form molecular loops.

  Inorganic chemistry 20010129