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Home Boronic acids 3-(4-Methoxy)benzyloxy-5-trifluoromethylphenylboronic acid

3-(4-Methoxy)benzyloxy-5-trifluoromethylphenylboronic acid

CAS No.:
913835-77-5
Catalog Number:
AG006NKF
Molecular Formula:
C15H14BF3O4
Molecular Weight:
326.0755
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$125
- +
5g
97%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG006NKF
Chemical Name:
3-(4-Methoxy)benzyloxy-5-trifluoromethylphenylboronic acid
CAS Number:
913835-77-5
Molecular Formula:
C15H14BF3O4
Molecular Weight:
326.0755
MDL Number:
MFCD08689490
IUPAC Name:
[3-[(4-methoxyphenyl)methoxy]-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C15H14BF3O4/c1-22-13-4-2-10(3-5-13)9-23-14-7-11(15(17,18)19)6-12(8-14)16(20)21/h2-8,20-21H,9H2,1H3
InChI Key:
PONOBGDQRZFFPE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COc1cc(cc(c1)C(F)(F)F)B(O)O
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.094g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
326.078g/mol
Monoisotopic Mass:
326.094g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties