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

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

CAS No.:
2096338-38-2
Catalog Number:
AG01EHK5
Molecular Formula:
C7H4BBrF4O2
Molecular Weight:
286.8141
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG01EHK5
Chemical Name:
3-Bromo-2-fluoro-5-trifluoromethylphenylboronic acid
CAS Number:
2096338-38-2
Molecular Formula:
C7H4BBrF4O2
Molecular Weight:
286.8141
MDL Number:
MFCD20441821
IUPAC Name:
[3-bromo-2-fluoro-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H4BBrF4O2/c9-5-2-3(7(11,12)13)1-4(6(5)10)8(14)15/h1-2,14-15H
InChI Key:
VWFBSZFKKNFRJJ-UHFFFAOYSA-N
SMILES:
OB(c1cc(cc(c1F)Br)C(F)(F)F)O
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