2359-09-3 | 5-tert-Butylisophthalic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$16.00	$11.00
5g	95%	in stock	$38.00	$26.00
10g	95%	in stock	$65.00	$45.00
25g	95%	in stock	$102.00	$71.00
100g	95%	in stock	$364.00	$255.00
500g	95%	in stock	$1,505.00	$1,054.00

Description

• Catalog Number: AB23952
• Chemical Name: 5-tert-Butylisophthalic acid
• CAS Number: 2359-09-3
• Molecular Formula: C12H14O4
• Molecular Weight: 222.2372
• MDL Number: MFCD00067047
• SMILES: OC(=O)c1cc(cc(c1)C(C)(C)C)C(=O)O

Computed Properties

• Complexity: 268
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 3
• XLogP3: 2.6

Literature

• A tri-layer structure consisting of novel heptacobaltate clusters and single cobalt centers bridged by 5-tert-butyl isophthalate.

  Dalton transactions (Cambridge, England : 2003) 20111014

• Poly[(μ(2)-4,4'-bipyridine)bis-(μ(4)-5-tert-butyl-isophthalato)bis-(μ(3)-5-tert-butyl-isophthalato)di-μ(3)-hydroxido-penta-zinc(II)].

  Acta crystallographica. Section E, Structure reports online 20090901

• Self-assembly of a series of cobalt(II) coordination polymers constructed from H2tbip and dipyridyl-based ligands.

  Inorganic chemistry 20090202

• catena-Poly[[(2,2'-bipyridine)copper(II)]-μ-5-tert-butyl-isophthalato].

  Acta crystallographica. Section E, Structure reports online 20081201

• Zn(tbip) (H2tbip= 5-tert-butyl isophthalic acid): a highly stable guest-free microporous metal organic framework with unique gas separation capability.

  Journal of the American Chemical Society 20060405