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Home > Boronic Acids > 501435-91-2
501435-91-2 | Boronic acid, (5-bromo-2-fluoro-3-pyridinyl)-
CAS No: 501435-91-2 Catalog No: AG00I8YN MDL No:MFCD04039317
Product Description
Catalog Number:
AG00I8YN
Chemical Name:
Boronic acid, (5-bromo-2-fluoro-3-pyridinyl)-
CAS Number:
501435-91-2
Molecular Formula:
C5H4BBrFNO2
Molecular Weight:
219.8042
MDL Number:
MFCD04039317
IUPAC Name:
(5-bromo-2-fluoropyridin-3-yl)boronic acid
InChI:
InChI=1S/C5H4BBrFNO2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2,10-11H
InChI Key:
YAXKWQSQZIVTFC-UHFFFAOYSA-N
SMILES:
Brc1cnc(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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