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Home > Boronic Acids > 1072951-43-9
1072951-43-9 | (2-Bromo-5-fluoropyridin-4-yl);boronic acid
CAS No: 1072951-43-9 Catalog No: AG007ES2 MDL No:MFCD04973353
Product Description
Catalog Number:
AG007ES2
Chemical Name:
(2-Bromo-5-fluoropyridin-4-yl);boronic acid
CAS Number:
1072951-43-9
Molecular Formula:
C5H4BBrFNO2
Molecular Weight:
219.8042
MDL Number:
MFCD04973353
IUPAC Name:
(2-bromo-5-fluoropyridin-4-yl)boronic acid
InChI:
InChI=1S/C5H4BBrFNO2/c7-5-1-3(6(10)11)4(8)2-9-5/h1-2,10-11H
InChI Key:
AXQCYFLMAUPOLN-UHFFFAOYSA-N
SMILES:
Brc1ncc(c(c1)B(O)O)F
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.95g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.804g/mol
Monoisotopic Mass:
218.95g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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