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Home > Boronic Acids > 1256359-88-2
1256359-88-2 | Benzeneacetamide, N-(1-methylethyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1256359-88-2 Catalog No: AG000O71 MDL No:MFCD17015828
Product Description
Catalog Number:
AG000O71
Chemical Name:
Benzeneacetamide, N-(1-methylethyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1256359-88-2
Molecular Formula:
C17H26BNO3
Molecular Weight:
303.2042
MDL Number:
MFCD17015828
IUPAC Name:
N-propan-2-yl-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
InChI:
InChI=1S/C17H26BNO3/c1-12(2)19-15(20)11-13-8-7-9-14(10-13)18-21-16(3,4)17(5,6)22-18/h7-10,12H,11H2,1-6H3,(H,19,20)
InChI Key:
FIUUPCPMJWVMMT-UHFFFAOYSA-N
SMILES:
CC(NC(=O)Cc1cccc(c1)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.201g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.209g/mol
Monoisotopic Mass:
303.201g/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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