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Home > Boronic Acids > 836615-83-9
836615-83-9 | (2,6-Difluoro-3-((2-fluorobenzyl)oxy)phenyl)boronic acid
CAS No: 836615-83-9 Catalog No: AG003G41 MDL No:MFCD07784354
Product Description
Catalog Number:
AG003G41
Chemical Name:
(2,6-Difluoro-3-((2-fluorobenzyl)oxy)phenyl)boronic acid
CAS Number:
836615-83-9
Molecular Formula:
C13H10BF3O3
Molecular Weight:
282.0229
MDL Number:
MFCD07784354
IUPAC Name:
[2,6-difluoro-3-[(2-fluorophenyl)methoxy]phenyl]boronic acid
InChI:
InChI=1S/C13H10BF3O3/c15-9-4-2-1-3-8(9)7-20-11-6-5-10(16)12(13(11)17)14(18)19/h1-6,18-19H,7H2
InChI Key:
FZRDUMLPMRLTOK-UHFFFAOYSA-N
SMILES:
Fc1ccccc1COc1ccc(c(c1F)B(O)O)F
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.068g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.025g/mol
Monoisotopic Mass:
282.068g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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