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Home > Boronic Acids > 1129541-03-2
1129541-03-2 | 4-(3-fluoro-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)Morpholine
CAS No: 1129541-03-2 Catalog No: AG0095K9 MDL No:MFCD22570784
Product Description
Catalog Number:
AG0095K9
Chemical Name:
4-(3-fluoro-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)Morpholine
CAS Number:
1129541-03-2
Molecular Formula:
C16H23BFNO3
Molecular Weight:
307.1681
MDL Number:
MFCD22570784
IUPAC Name:
4-[3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine
InChI:
InChI=1S/C16H23BFNO3/c1-15(2)16(3,4)22-17(21-15)12-9-13(18)11-14(10-12)19-5-7-20-8-6-19/h9-11H,5-8H2,1-4H3
InChI Key:
RTEFOWFSMDQVNH-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)B1OC(C(O1)(C)C)(C)C)N1CCOCC1
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.176g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.172g/mol
Monoisotopic Mass:
307.176g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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