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Home > Boronic Acids > 1201644-47-4
1201644-47-4 | Methanone, 4-morpholinyl[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-
CAS No: 1201644-47-4 Catalog No: AG000QFI MDL No:MFCD16995584
Product Description
Catalog Number:
AG000QFI
Chemical Name:
Methanone, 4-morpholinyl[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-
CAS Number:
1201644-47-4
Molecular Formula:
C16H23BN2O4
Molecular Weight:
318.1758
MDL Number:
MFCD16995584
IUPAC Name:
morpholin-4-yl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]methanone
InChI:
InChI=1S/C16H23BN2O4/c1-15(2)16(3,4)23-17(22-15)12-5-6-13(18-11-12)14(20)19-7-9-21-10-8-19/h5-6,11H,7-10H2,1-4H3
InChI Key:
JTDABKRZHRRDOB-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cn1)B1OC(C(O1)(C)C)(C)C)N1CCOCC1
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.175g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.18g/mol
Monoisotopic Mass:
318.175g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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