Home Aminos [(3,5-Difluorophenyl)amino](oxo)acetic acid

[(3,5-Difluorophenyl)amino](oxo)acetic acid

CAS No.:
1060817-53-9
Catalog Number:
AG008VDT
Molecular Formula:
C8H5F2NO3
Molecular Weight:
201.1270
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG008VDT
Chemical Name:
[(3,5-Difluorophenyl)amino](oxo)acetic acid
CAS Number:
1060817-53-9
Molecular Formula:
C8H5F2NO3
Molecular Weight:
201.1270
MDL Number:
MFCD11053976
IUPAC Name:
2-(3,5-difluoroanilino)-2-oxoacetic acid
InChI:
InChI=1S/C8H5F2NO3/c9-4-1-5(10)3-6(2-4)11-7(12)8(13)14/h1-3H,(H,11,12)(H,13,14)
InChI Key:
MHBVCCASECNRLD-UHFFFAOYSA-N
SMILES:
O=C(C(=O)O)Nc1cc(F)cc(c1)F
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.129g/mol
Monoisotopic Mass:
201.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties