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Home Boronic acids 2-Isobutoxy-5-(trifluoromethyl)phenylboronic acid

2-Isobutoxy-5-(trifluoromethyl)phenylboronic acid

CAS No.:
1256345-99-9
Catalog Number:
AG000O0G
Molecular Formula:
C11H14BF3O3
Molecular Weight:
262.0333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$300
- +
25g
95%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG000O0G
Chemical Name:
2-Isobutoxy-5-(trifluoromethyl)phenylboronic acid
CAS Number:
1256345-99-9
Molecular Formula:
C11H14BF3O3
Molecular Weight:
262.0333
MDL Number:
MFCD16036116
IUPAC Name:
[2-(2-methylpropoxy)-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H14BF3O3/c1-7(2)6-18-10-4-3-8(11(13,14)15)5-9(10)12(16)17/h3-5,7,16-17H,6H2,1-2H3
InChI Key:
YYWZYPLOMFBKDT-UHFFFAOYSA-N
SMILES:
CC(COc1ccc(cc1B(O)O)C(F)(F)F)C
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.099g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.035g/mol
Monoisotopic Mass:
262.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties