Home Boronic acids 4-(N,N-Dimethylsulfamoyl)-2-trifluoromethylphenylboronic acid

4-(N,N-Dimethylsulfamoyl)-2-trifluoromethylphenylboronic acid

CAS No.:
1279107-82-2
Catalog Number:
AG000XJI
Molecular Formula:
C9H11BF3NO4S
Molecular Weight:
297.0591
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$188
- +
1g
96%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG000XJI
Chemical Name:
4-(N,N-Dimethylsulfamoyl)-2-trifluoromethylphenylboronic acid
CAS Number:
1279107-82-2
Molecular Formula:
C9H11BF3NO4S
Molecular Weight:
297.0591
MDL Number:
MFCD18783152
IUPAC Name:
[4-(dimethylsulfamoyl)-2-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C9H11BF3NO4S/c1-14(2)19(17,18)6-3-4-8(10(15)16)7(5-6)9(11,12)13/h3-5,15-16H,1-2H3
InChI Key:
SYZSCAQVGVKZPK-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1C(F)(F)F)S(=O)(=O)N(C)C)O
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.045g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.055g/mol
Monoisotopic Mass:
297.045g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties