Home Sulfos 1,1,1-trifluoro-N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanesulfonamide

1,1,1-trifluoro-N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanesulfonamide

CAS No.:
1605331-75-6
Catalog Number:
AG01EHYE
Molecular Formula:
C13H17BF3NO4S
Molecular Weight:
351.1496
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Product Description
Catalog Number:
AG01EHYE
Chemical Name:
1,1,1-trifluoro-N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanesulfonamide
CAS Number:
1605331-75-6
Molecular Formula:
C13H17BF3NO4S
Molecular Weight:
351.1496
MDL Number:
MFCD31916441
IUPAC Name:
1,1,1-trifluoro-N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
InChI:
InChI=1S/C13H17BF3NO4S/c1-11(2)12(3,4)22-14(21-11)9-6-5-7-10(8-9)18-23(19,20)13(15,16)17/h5-8,18H,1-4H3
InChI Key:
RBFSYFCTXISCML-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Complexity:
528  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.092g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
351.147g/mol
Monoisotopic Mass:
351.092g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties