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Home > Boronic Acids > 1150271-66-1
1150271-66-1 | Acetamide, N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]-
CAS No: 1150271-66-1 Catalog No: AG000FQN MDL No:MFCD11855983
Product Description
Catalog Number:
AG000FQN
Chemical Name:
Acetamide, N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]-
CAS Number:
1150271-66-1
Molecular Formula:
C15H19BF3NO3
Molecular Weight:
329.1225
MDL Number:
MFCD11855983
IUPAC Name:
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)phenyl]acetamide
InChI:
InChI=1S/C15H19BF3NO3/c1-9(21)20-12-7-6-10(8-11(12)15(17,18)19)16-22-13(2,3)14(4,5)23-16/h6-8H,1-5H3,(H,20,21)
InChI Key:
LBTMJYMEGPLBQY-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.141g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.126g/mol
Monoisotopic Mass:
329.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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