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Home > Boronic Acids > 1333388-00-3
1333388-00-3 | 3-fluoro-4-(MorpholinoMethyl)phenylboronic acid
CAS No: 1333388-00-3 Catalog No: AG009YI7 MDL No:MFCD16198064
Product Description
Catalog Number:
AG009YI7
Chemical Name:
3-fluoro-4-(MorpholinoMethyl)phenylboronic acid
CAS Number:
1333388-00-3
Molecular Formula:
C11H15BFNO3
Molecular Weight:
239.0511
MDL Number:
MFCD16198064
IUPAC Name:
[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H15BFNO3/c13-11-7-10(12(15)16)2-1-9(11)8-14-3-5-17-6-4-14/h1-2,7,15-16H,3-6,8H2
InChI Key:
ASQRNGXPPOBPJM-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1CN1CCOCC1)B(O)O
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.113g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.053g/mol
Monoisotopic Mass:
239.113g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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