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Home > Boronic Acids > 1596367-55-3
1596367-55-3 | 2(1H)-Pyridinone, 1-cyclopropyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1596367-55-3 Catalog No: AG001R90 MDL No:MFCD16996103
Product Description
Catalog Number:
AG001R90
Chemical Name:
2(1H)-Pyridinone, 1-cyclopropyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1596367-55-3
Molecular Formula:
C14H20BNO3
Molecular Weight:
261.1245
MDL Number:
MFCD16996103
IUPAC Name:
1-cyclopropyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one
InChI:
InChI=1S/C14H20BNO3/c1-13(2)14(3,4)19-15(18-13)10-5-8-12(17)16(9-10)11-6-7-11/h5,8-9,11H,6-7H2,1-4H3
InChI Key:
PSQKCGSTAZGHCJ-UHFFFAOYSA-N
SMILES:
O=c1ccc(cn1C1CC1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.154g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.128g/mol
Monoisotopic Mass:
261.154g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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