Home Boronic acids 4-Difluoromethoxy-3-methyl-benzeneboronic acid

4-Difluoromethoxy-3-methyl-benzeneboronic acid

CAS No.:
958451-72-4
Catalog Number:
AG00IJH0
Molecular Formula:
C8H9BF2O3
Molecular Weight:
201.9631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$175
- +
5g
98%
In Stock USA
United States
$525
- +
10g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00IJH0
Chemical Name:
4-Difluoromethoxy-3-methyl-benzeneboronic acid
CAS Number:
958451-72-4
Molecular Formula:
C8H9BF2O3
Molecular Weight:
201.9631
MDL Number:
MFCD11036079
IUPAC Name:
[4-(difluoromethoxy)-3-methylphenyl]boronic acid
InChI:
InChI=1S/C8H9BF2O3/c1-5-4-6(9(12)13)2-3-7(5)14-8(10)11/h2-4,8,12-13H,1H3
InChI Key:
HNSXGLPRKOFDNV-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1C)B(O)O)F
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.964g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties