455-40-3 | 3,5-Difluorobenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
10g	98%	in stock	$6.00	$5.00
25g	98%	in stock	$14.00	$10.00
100g	98%	in stock	$43.00	$30.00
500g	98%	in stock	$210.00	$147.00

Description

• Catalog Number: AB63916
• Chemical Name: 3,5-Difluorobenzoic acid
• CAS Number: 455-40-3
• Molecular Formula: C7H4F2O2
• Molecular Weight: 158.1023
• MDL Number: MFCD00010323
• SMILES: OC(=O)c1cc(F)cc(c1)F
• NSC Number: 403726

Computed Properties

• Complexity: 151
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.8

Literature

• Bis(μ-3,5-difluorobenzoato)bis[(3,5-di-fluorobenzoato)dimethyltin(IV)].

  Acta crystallographica. Section E, Structure reports online 20110201

• Tuning of the ionization potential of paddlewheel diruthenium(II, II) complexes with fluorine atoms on the benzoate ligands.

  Dalton transactions (Cambridge, England : 2003) 20110121

• Hyperpolarized (13)C magnetic resonance detection of carboxypeptidase G2 activity.

  Magnetic resonance in medicine 20091101

• 2,3-Difluoro-benzoic acid.

  Acta crystallographica. Section E, Structure reports online 20080201

• The first hexanuclear copper(I) carboxylate: X-ray crystal structure and reactivity in solution and gas-phase reactions.

  Inorganic chemistry 20070917