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Home > Boronic Acids > 1333222-45-9

1333222-45-9

1333222-45-9 | Pyridine, 3-fluoro-2-(phenylmethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

CAS No: 1333222-45-9 Catalog No: AG0014MO MDL No:MFCD18207246

Product Description

Catalog Number:
AG0014MO
Chemical Name:
Pyridine, 3-fluoro-2-(phenylmethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1333222-45-9
Molecular Formula:
C18H21BFNO3
Molecular Weight:
329.1736
MDL Number:
MFCD18207246
IUPAC Name:
3-fluoro-2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C18H21BFNO3/c1-17(2)18(3,4)24-19(23-17)14-10-15(20)16(21-11-14)22-12-13-8-6-5-7-9-13/h5-11H,12H2,1-4H3
InChI Key:
NPCDRYABULDPRH-UHFFFAOYSA-N
SMILES:
Fc1cc(cnc1OCc1ccccc1)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
413  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.16g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.178g/mol
Monoisotopic Mass:
329.16g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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