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

4-Isopropoxy-2-(trifluoromethyl)phenylboronic acid

CAS No.:
313545-40-3
Catalog Number:
AG00BXS7
Molecular Formula:
C10H12BF3O3
Molecular Weight:
248.0067
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00BXS7
Chemical Name:
4-Isopropoxy-2-(trifluoromethyl)phenylboronic acid
CAS Number:
313545-40-3
Molecular Formula:
C10H12BF3O3
Molecular Weight:
248.0067
MDL Number:
MFCD04972373
IUPAC Name:
[4-propan-2-yloxy-2-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H12BF3O3/c1-6(2)17-7-3-4-9(11(15)16)8(5-7)10(12,13)14/h3-6,15-16H,1-2H3
InChI Key:
MQWMPOPSYRZCAI-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(c(c1)C(F)(F)F)B(O)O)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.083g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
248.008g/mol
Monoisotopic Mass:
248.083g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties