Home Carboxys 1-(3,5-difluorophenyl)-2-oxopyrrolidine-3-carboxylic acid

1-(3,5-difluorophenyl)-2-oxopyrrolidine-3-carboxylic acid

CAS No.:
1016509-99-1
Catalog Number:
AG019WZV
Molecular Formula:
C11H9F2NO3
Molecular Weight:
241.1909
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Product Description
Catalog Number:
AG019WZV
Chemical Name:
1-(3,5-difluorophenyl)-2-oxopyrrolidine-3-carboxylic acid
CAS Number:
1016509-99-1
Molecular Formula:
C11H9F2NO3
Molecular Weight:
241.1909
MDL Number:
MFCD09806122
IUPAC Name:
1-(3,5-difluorophenyl)-2-oxopyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C11H9F2NO3/c12-6-3-7(13)5-8(4-6)14-2-1-9(10(14)15)11(16)17/h3-5,9H,1-2H2,(H,16,17)
InChI Key:
YLMGZOAUYHOWFU-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(C1=O)c1cc(F)cc(c1)F
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.055g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.194g/mol
Monoisotopic Mass:
241.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties