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Home Boronic acids 4-(N-tert-Butylsulfamoyl)-2-trifluoromethylphenylboronic acid

4-(N-tert-Butylsulfamoyl)-2-trifluoromethylphenylboronic acid

CAS No.:
2096333-30-9
Catalog Number:
AG01EH9X
Molecular Formula:
C11H15BF3NO4S
Molecular Weight:
325.1123
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$207
- +
1g
97%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG01EH9X
Chemical Name:
4-(N-tert-Butylsulfamoyl)-2-trifluoromethylphenylboronic acid
CAS Number:
2096333-30-9
Molecular Formula:
C11H15BF3NO4S
Molecular Weight:
325.1123
MDL Number:
MFCD18783146
IUPAC Name:
[4-(tert-butylsulfamoyl)-2-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H15BF3NO4S/c1-10(2,3)16-21(19,20)7-4-5-9(12(17)18)8(6-7)11(13,14)15/h4-6,16-18H,1-3H3
InChI Key:
HMGRMEBSMVAFEP-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1C(F)(F)F)S(=O)(=O)NC(C)(C)C)O
Properties
Complexity:
456  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.077g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
325.109g/mol
Monoisotopic Mass:
325.077g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties