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Home > Boronic Acids > 1256355-28-8
1256355-28-8 | Boronic acid, B-[3-fluoro-2-(4-morpholinyl)-4-pyridinyl]-
CAS No: 1256355-28-8 Catalog No: AG000O3G MDL No:MFCD16660287
Product Description
Catalog Number:
AG000O3G
Chemical Name:
Boronic acid, B-[3-fluoro-2-(4-morpholinyl)-4-pyridinyl]-
CAS Number:
1256355-28-8
Molecular Formula:
C9H12BFN2O3
Molecular Weight:
226.0126
MDL Number:
MFCD16660287
IUPAC Name:
(3-fluoro-2-morpholin-4-ylpyridin-4-yl)boronic acid
InChI:
InChI=1S/C9H12BFN2O3/c11-8-7(10(14)15)1-2-12-9(8)13-3-5-16-6-4-13/h1-2,14-15H,3-6H2
InChI Key:
KKEINPUABSQWEE-UHFFFAOYSA-N
SMILES:
OB(c1ccnc(c1F)N1CCOCC1)O
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.093g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.014g/mol
Monoisotopic Mass:
226.093g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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