83506-93-8 | 2-Amino-4,5-difluorobenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$15.00	$10.00
5g	95%	in stock	$19.00	$13.00
25g	95%	in stock	$30.00	$21.00

Description

• Catalog Number: AB61022
• Chemical Name: 2-Amino-4,5-difluorobenzoic acid
• CAS Number: 83506-93-8
• Molecular Formula: C7H5F2NO2
• Molecular Weight: 173.1169064
• MDL Number: MFCD00077509
• SMILES: OC(=O)c1cc(F)c(cc1N)F

Computed Properties

• Complexity: 188
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 1.5

Literature

• FT-IR, Raman and DFT study of 2-amino-5-fluorobenzoic acid and its biological activity with other halogen (Cl, Br) substitution.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110701

• FT-Raman and FT-IR spectra, ab initio and density functional studies of 2-amino-4,5-difluorobenzoic acid.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20070601