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Home > Boronic Acids > 874219-43-9
874219-43-9 | (3-Fluoro-5-(piperidine-1-carbonyl)phenyl)boronic acid
CAS No: 874219-43-9 Catalog No: AG008DKK MDL No:MFCD08235060
Product Description
Catalog Number:
AG008DKK
Chemical Name:
(3-Fluoro-5-(piperidine-1-carbonyl)phenyl)boronic acid
CAS Number:
874219-43-9
Molecular Formula:
C12H15BFNO3
Molecular Weight:
251.0618
MDL Number:
MFCD08235060
IUPAC Name:
[3-fluoro-5-(piperidine-1-carbonyl)phenyl]boronic acid
InChI:
InChI=1S/C12H15BFNO3/c14-11-7-9(6-10(8-11)13(17)18)12(16)15-4-2-1-3-5-15/h6-8,17-18H,1-5H2
InChI Key:
NOYBFSLBXRVANN-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)B(O)O)C(=O)N1CCCCC1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.113g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.064g/mol
Monoisotopic Mass:
251.113g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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