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Home > Boronic Acids > 1150271-56-9
1150271-56-9 | Acetamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethoxy)phenyl]-
CAS No: 1150271-56-9 Catalog No: AG000FPS MDL No:MFCD11855975
Product Description
Catalog Number:
AG000FPS
Chemical Name:
Acetamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethoxy)phenyl]-
CAS Number:
1150271-56-9
Molecular Formula:
C15H19BF3NO4
Molecular Weight:
345.1219
MDL Number:
MFCD11855975
IUPAC Name:
N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethoxy)phenyl]acetamide
InChI:
InChI=1S/C15H19BF3NO4/c1-9(21)20-12-8-10(22-15(17,18)19)6-7-11(12)16-23-13(2,3)14(4,5)24-16/h6-8H,1-5H3,(H,20,21)
InChI Key:
OLWPFRXCCCYAMH-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(ccc1B1OC(C(O1)(C)C)(C)C)OC(F)(F)F
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.136g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
345.125g/mol
Monoisotopic Mass:
345.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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