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Home Boronic acids 5-Bromo-2-fluoro-3-trifluoromethylphenylboronic acid

5-Bromo-2-fluoro-3-trifluoromethylphenylboronic acid

CAS No.:
2096341-70-5
Catalog Number:
AG01EHO7
Molecular Formula:
C7H4BBrF4O2
Molecular Weight:
286.8141
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
100g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG01EHO7
Chemical Name:
5-Bromo-2-fluoro-3-trifluoromethylphenylboronic acid
CAS Number:
2096341-70-5
Molecular Formula:
C7H4BBrF4O2
Molecular Weight:
286.8141
MDL Number:
MFCD18311845
IUPAC Name:
[5-bromo-2-fluoro-3-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H4BBrF4O2/c9-3-1-4(7(11,12)13)6(10)5(2-3)8(14)15/h1-2,14-15H
InChI Key:
WRIJOUMGMHQBFI-UHFFFAOYSA-N
SMILES:
Brc1cc(B(O)O)c(c(c1)C(F)(F)F)F
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.942g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
286.815g/mol
Monoisotopic Mass:
285.942g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties