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Home Boronic acids 5-(Benzyloxy)-2-fluoro-3-(trifluoromethyl)phenylboronic acid

5-(Benzyloxy)-2-fluoro-3-(trifluoromethyl)phenylboronic acid

CAS No.:
2096331-25-6
Catalog Number:
AG01EHQH
Molecular Formula:
C14H11BF4O3
Molecular Weight:
314.0400
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$225
- +
5g
98%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG01EHQH
Chemical Name:
5-(Benzyloxy)-2-fluoro-3-(trifluoromethyl)phenylboronic acid
CAS Number:
2096331-25-6
Molecular Formula:
C14H11BF4O3
Molecular Weight:
314.0400
MDL Number:
MFCD19981510
IUPAC Name:
[2-fluoro-5-phenylmethoxy-3-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C14H11BF4O3/c16-13-11(14(17,18)19)6-10(7-12(13)15(20)21)22-8-9-4-2-1-3-5-9/h1-7,20-21H,8H2
InChI Key:
OMODPVQWZOGPCV-UHFFFAOYSA-N
SMILES:
OB(c1cc(OCc2ccccc2)cc(c1F)C(F)(F)F)O
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.074g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
314.043g/mol
Monoisotopic Mass:
314.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties