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Home Aminos [(2-Fluorophenyl)amino](oxo)acetic acid

[(2-Fluorophenyl)amino](oxo)acetic acid

CAS No.:
84944-15-0
Catalog Number:
AG00G4H9
Molecular Formula:
C8H6FNO3
Molecular Weight:
183.1365
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$88
- +
5g
96%
In Stock USA
United States
$257
- +
10g
96%
In Stock USA
United States
$475
- +
25g
96%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG00G4H9
Chemical Name:
[(2-Fluorophenyl)amino](oxo)acetic acid
CAS Number:
84944-15-0
Molecular Formula:
C8H6FNO3
Molecular Weight:
183.1365
MDL Number:
MFCD09864514
IUPAC Name:
2-(2-fluoroanilino)-2-oxoacetic acid
InChI:
InChI=1S/C8H6FNO3/c9-5-3-1-2-4-6(5)10-7(11)8(12)13/h1-4H,(H,10,11)(H,12,13)
InChI Key:
ZZJNRZPPZXFTAG-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)Nc1ccccc1F
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.033g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.138g/mol
Monoisotopic Mass:
183.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
2-Fluoro-anilinium N-(2-fluoro-phenyl)oxamate. Acta crystallographica. Section E, Structure reports online 20080501
Properties