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Home > Boronic Acids > 1256359-83-7
1256359-83-7 | N-tert-Butyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide
CAS No: 1256359-83-7 Catalog No: AG009BRD MDL No:MFCD16618971
Product Description
Catalog Number:
AG009BRD
Chemical Name:
N-tert-Butyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide
CAS Number:
1256359-83-7
Molecular Formula:
C18H28BNO3
Molecular Weight:
317.2308
MDL Number:
MFCD16618971
IUPAC Name:
N-tert-butyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
InChI:
InChI=1S/C18H28BNO3/c1-16(2,3)20-15(21)12-13-8-10-14(11-9-13)19-22-17(4,5)18(6,7)23-19/h8-11H,12H2,1-7H3,(H,20,21)
InChI Key:
XRBKWAMLZWELDF-UHFFFAOYSA-N
SMILES:
O=C(NC(C)(C)C)Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.216g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.236g/mol
Monoisotopic Mass:
317.216g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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