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Home Other Building Blocks 2,6-Difluorobenzoic acid

2,6-Difluorobenzoic acid

CAS No.:
385-00-2
Catalog Number:
AG00331K
Molecular Formula:
C7H4F2O2
Molecular Weight:
158.1023
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
500g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG00331K
Chemical Name:
2,6-Difluorobenzoic acid
CAS Number:
385-00-2
Molecular Formula:
C7H4F2O2
Molecular Weight:
158.1023
MDL Number:
MFCD00002411
IUPAC Name:
2,6-difluorobenzoic acid
InChI:
InChI=1S/C7H4F2O2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11)
InChI Key:
ONOTYLMNTZNAQZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(F)cccc1F
EC Number:
206-856-3
NSC Number:
126584
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.018g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.104g/mol
Monoisotopic Mass:
158.018g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Tuning of the ionization potential of paddlewheel diruthenium(II, II) complexes with fluorine atoms on the benzoate ligands. Dalton transactions (Cambridge, England : 2003) 20110121
N-(4-Cyano-phen-yl)-2,6-difluoro-benzamide. Acta crystallographica. Section E, Structure reports online 20101201
2,6-Difluoro-benzoic acid. Acta crystallographica. Section E, Structure reports online 20100801
5-(2,6-Difluoro-phen-yl)-1,3,4-thia-diazol-2-amine. Acta crystallographica. Section E, Structure reports online 20091201
Synthesis and insecticidal evaluation of propesticides of benzoylphenylureas. Journal of agricultural and food chemistry 20050112
Solid-state structures of zinc(II) benzoate complexes. Catalyst precursors for the coupling of carbon dioxide and epoxides. Inorganic chemistry 20020225
Transformation of the insecticide teflubenzuron by microorganisms. Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20010901
Properties