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Home > Boronic Acids > 1032758-87-4
1032758-87-4 | tert-Butyl methyl(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);pyridin-2-yl);carbamate
CAS No: 1032758-87-4 Catalog No: AG003UKX MDL No:MFCD09037484
Product Description
Catalog Number:
AG003UKX
Chemical Name:
tert-Butyl methyl(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);pyridin-2-yl);carbamate
CAS Number:
1032758-87-4
Molecular Formula:
C17H27BN2O4
Molecular Weight:
334.2183
MDL Number:
MFCD09037484
IUPAC Name:
tert-butyl N-methyl-N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamate
InChI:
InChI=1S/C17H27BN2O4/c1-15(2,3)22-14(21)20(8)13-10-9-12(11-19-13)18-23-16(4,5)17(6,7)24-18/h9-11H,1-8H3
InChI Key:
QGBJKHALDLKAGX-UHFFFAOYSA-N
SMILES:
O=C(N(c1ccc(cn1)B1OC(C(O1)(C)C)(C)C)C)OC(C)(C)C
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.206g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.223g/mol
Monoisotopic Mass:
334.206g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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