Home Boronic acids 3-Nitro-4-(trifluoromethoxy)phenylboronic acid

3-Nitro-4-(trifluoromethoxy)phenylboronic acid

CAS No.:
2096333-99-0
Catalog Number:
AG01EHE3
Molecular Formula:
C7H5BF3NO5
Molecular Weight:
250.9245
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$313
- +
5g
97%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG01EHE3
Chemical Name:
3-Nitro-4-(trifluoromethoxy)phenylboronic acid
CAS Number:
2096333-99-0
Molecular Formula:
C7H5BF3NO5
Molecular Weight:
250.9245
MDL Number:
MFCD21332921
IUPAC Name:
[3-nitro-4-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C7H5BF3NO5/c9-7(10,11)17-6-2-1-4(8(13)14)3-5(6)12(15)16/h1-3,13-14H
InChI Key:
HEYISZILWXZDPS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1OC(F)(F)F)B(O)O
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.021g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.924g/mol
Monoisotopic Mass:
251.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties