Home Boronic acids 3-Butoxy-5-(trifluoromethoxy)phenylboronic acid

3-Butoxy-5-(trifluoromethoxy)phenylboronic acid

CAS No.:
1256345-96-6
Catalog Number:
AG000O0J
Molecular Formula:
C11H14BF3O4
Molecular Weight:
278.0327
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
25g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG000O0J
Chemical Name:
3-Butoxy-5-(trifluoromethoxy)phenylboronic acid
CAS Number:
1256345-96-6
Molecular Formula:
C11H14BF3O4
Molecular Weight:
278.0327
MDL Number:
MFCD16036112
IUPAC Name:
[3-butoxy-5-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C11H14BF3O4/c1-2-3-4-18-9-5-8(12(16)17)6-10(7-9)19-11(13,14)15/h5-7,16-17H,2-4H2,1H3
InChI Key:
LJAITWONDCKJGB-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(cc(c1)B(O)O)OC(F)(F)F
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.094g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
278.034g/mol
Monoisotopic Mass:
278.094g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties