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Home Boronic acids B-[2-Fluoro-4-(1-pyrrolidinylcarbonyl)phenyl]boronic acid

B-[2-Fluoro-4-(1-pyrrolidinylcarbonyl)phenyl]boronic acid

CAS No.:
874289-25-5
Catalog Number:
AG00IEIY
Molecular Formula:
C11H13BFNO3
Molecular Weight:
237.0352
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Product Description
Catalog Number:
AG00IEIY
Chemical Name:
B-[2-Fluoro-4-(1-pyrrolidinylcarbonyl)phenyl]boronic acid
CAS Number:
874289-25-5
Molecular Formula:
C11H13BFNO3
Molecular Weight:
237.0352
MDL Number:
MFCD16036548
IUPAC Name:
[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]boronic acid
InChI:
InChI=1S/C11H13BFNO3/c13-10-7-8(3-4-9(10)12(16)17)11(15)14-5-1-2-6-14/h3-4,7,16-17H,1-2,5-6H2
InChI Key:
XNEOXUHAOKJOON-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)F)B(O)O)N1CCCC1
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.097g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.037g/mol
Monoisotopic Mass:
237.097g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties