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Home Boronic acids 4-Butoxy-2-(trifluoromethyl)phenylboronic acid

4-Butoxy-2-(trifluoromethyl)phenylboronic acid

CAS No.:
2096331-14-3
Catalog Number:
AG01EHNM
Molecular Formula:
C11H14BF3O3
Molecular Weight:
262.0333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG01EHNM
Chemical Name:
4-Butoxy-2-(trifluoromethyl)phenylboronic acid
CAS Number:
2096331-14-3
Molecular Formula:
C11H14BF3O3
Molecular Weight:
262.0333
MDL Number:
MFCD19684108
IUPAC Name:
[4-butoxy-2-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H14BF3O3/c1-2-3-6-18-8-4-5-10(12(16)17)9(7-8)11(13,14)15/h4-5,7,16-17H,2-3,6H2,1H3
InChI Key:
UXMSSDWRCUPUMP-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(c(c1)C(F)(F)F)B(O)O
Properties
Complexity:
248  
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:
5  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties