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Home Boronic acids 5-fluoro-2-(isopropoxyMethyl)phenylboronic acid

5-fluoro-2-(isopropoxyMethyl)phenylboronic acid

CAS No.:
1333392-80-5
Catalog Number:
AG009YJ3
Molecular Formula:
C10H14BFO3
Molecular Weight:
212.0258
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Product Description
Catalog Number:
AG009YJ3
Chemical Name:
5-fluoro-2-(isopropoxyMethyl)phenylboronic acid
CAS Number:
1333392-80-5
Molecular Formula:
C10H14BFO3
Molecular Weight:
212.0258
MDL Number:
MFCD14687289
IUPAC Name:
[5-fluoro-2-(propan-2-yloxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H14BFO3/c1-7(2)15-6-8-3-4-9(12)5-10(8)11(13)14/h3-5,7,13-14H,6H2,1-2H3
InChI Key:
NMKVOYZVOGHDAI-UHFFFAOYSA-N
SMILES:
CC(OCc1ccc(cc1B(O)O)F)C
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.102g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
212.027g/mol
Monoisotopic Mass:
212.102g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties