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Home > Boronic Acids > 957198-29-7
957198-29-7 | 4-(3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)morpholine
CAS No: 957198-29-7 Catalog No: AG003JF0 MDL No:MFCD07781241
Product Description
Catalog Number:
AG003JF0
Chemical Name:
4-(3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)morpholine
CAS Number:
957198-29-7
Molecular Formula:
C15H22BFN2O3
Molecular Weight:
308.1562
MDL Number:
MFCD07781241
IUPAC Name:
4-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]morpholine
InChI:
InChI=1S/C15H22BFN2O3/c1-14(2)15(3,4)22-16(21-14)11-5-6-18-13(12(11)17)19-7-9-20-10-8-19/h5-6H,7-10H2,1-4H3
InChI Key:
PRTVABCMQIBLAP-UHFFFAOYSA-N
SMILES:
Fc1c(nccc1B1OC(C(O1)(C)C)(C)C)N1CCOCC1
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.171g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.16g/mol
Monoisotopic Mass:
308.171g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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