Home Boronic acids 3-(2,2,2-Trifluoroacetamido)phenylboronic acid

3-(2,2,2-Trifluoroacetamido)phenylboronic acid

CAS No.:
88978-20-5
Catalog Number:
AG00454S
Molecular Formula:
C8H7BF3NO3
Molecular Weight:
232.9523
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$158
- +
5g
98%
In Stock USA
United States
$630
- +
Product Description
Catalog Number:
AG00454S
Chemical Name:
3-(2,2,2-Trifluoroacetamido)phenylboronic acid
CAS Number:
88978-20-5
Molecular Formula:
C8H7BF3NO3
Molecular Weight:
232.9523
MDL Number:
MFCD08235083
IUPAC Name:
[3-[(2,2,2-trifluoroacetyl)amino]phenyl]boronic acid
InChI:
InChI=1S/C8H7BF3NO3/c10-8(11,12)7(14)13-6-3-1-2-5(4-6)9(15)16/h1-4,15-16H,(H,13,14)
InChI Key:
NCOITLDGNKHMSB-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)Nc1cccc(c1)B(O)O
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.047g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
232.953g/mol
Monoisotopic Mass:
233.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties