6280-88-2 | 4-Chloro-2-nitrobenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
5g	97%	in stock	$12.00	$9.00
25g	97%	in stock	$18.00	$13.00
100g	97%	in stock	$38.00	$27.00
500g	97%	in stock	$46.00	$33.00

Description

• Catalog Number: AB67127
• Chemical Name: 4-Chloro-2-nitrobenzoic acid
• CAS Number: 6280-88-2
• Molecular Formula: C7H4ClNO4
• Molecular Weight: 201.5640
• MDL Number: MFCD00007214
• SMILES: Clc1ccc(c(c1)[N+](=O)[O-])C(=O)O
• NSC Number: 6158

Computed Properties

• Complexity: 227
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2.1

Literature

• Chemotaxis of Burkholderia sp. strain SJ98 towards chloronitroaromatic compounds that it can metabolise.

  BMC microbiology 20120101

• 4-Chloro-2-nitro-benzoic acid-pyrazine (2/1).

  Acta crystallographica. Section E, Structure reports online 20111201

• Hydrogen-bonded structures of the isomeric compounds of quinoline with 2-chloro-5-nitrobenzoic acid, 3-chloro-2-nitrobenzoic acid, 4-chloro-2-nitrobenzoic acid and 5-chloro-2-nitrobenzoic acid.

  Acta crystallographica. Section C, Crystal structure communications 20091001

• Two-component molecular crystals composed of chloronitrobenzoic acids and 4-aminopyridine.

  Acta crystallographica. Section C, Crystal structure communications 20020401