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Home > Boronic Acids > 1202805-27-3
1202805-27-3 | 1-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl)piperidin-4-one
CAS No: 1202805-27-3 Catalog No: AG00955B MDL No:MFCD09038340
Product Description
Catalog Number:
AG00955B
Chemical Name:
1-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl)piperidin-4-one
CAS Number:
1202805-27-3
Molecular Formula:
C15H22BN3O3
Molecular Weight:
303.1645
MDL Number:
MFCD09038340
IUPAC Name:
1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl]piperidin-4-one
InChI:
InChI=1S/C15H22BN3O3/c1-14(2)15(3,4)22-16(21-14)11-9-17-13(18-10-11)19-7-5-12(20)6-8-19/h9-10H,5-8H2,1-4H3
InChI Key:
NPMZOZZXAWXHLS-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1)c1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.175g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.169g/mol
Monoisotopic Mass:
303.175g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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