(3-bromo-5-fluoro-2-propan-2-yloxyphenyl)boronic acid


Chemical Name: (3-bromo-5-fluoro-2-propan-2-yloxyphenyl)boronic acid
CAS Number: 352534-84-0
Product Number: AG003BRC(AGN-PC-00UQ7C)
Synonyms:
MDL No:
Molecular Formula: C9H11BBrFO3
Molecular Weight: 276.8952

Identification/Properties


Properties
MP:
63-68°C(lit.);
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
276.896g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
275.997g/mol
Monoisotopic Mass:
275.997g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
206
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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