Home Boronic acids 4-(Morpholinosulfonyl)-2-trifluoromethylphenylboronic acid

4-(Morpholinosulfonyl)-2-trifluoromethylphenylboronic acid

CAS No.:
2096332-30-6
Catalog Number:
AG01EHHT
Molecular Formula:
C11H13BF3NO5S
Molecular Weight:
339.0958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$100
- +
5g
96%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG01EHHT
Chemical Name:
4-(Morpholinosulfonyl)-2-trifluoromethylphenylboronic acid
CAS Number:
2096332-30-6
Molecular Formula:
C11H13BF3NO5S
Molecular Weight:
339.0958
MDL Number:
MFCD18783148
IUPAC Name:
[4-morpholin-4-ylsulfonyl-2-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H13BF3NO5S/c13-11(14,15)9-7-8(1-2-10(9)12(17)18)22(19,20)16-3-5-21-6-4-16/h1-2,7,17-18H,3-6H2
InChI Key:
YXEYVMPXRUATEN-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1C(F)(F)F)S(=O)(=O)N1CCOCC1)O
Properties
Complexity:
475  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.056g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
339.092g/mol
Monoisotopic Mass:
339.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties