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Home > Boronic Acids > 504438-22-6
504438-22-6 | (R)-3-(3-fluoro-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)-5-(hydroxyMethyl)oxazolidin-2-one
CAS No: 504438-22-6 Catalog No: AG00DKYX MDL No:
Product Description
Catalog Number:
AG00DKYX
Chemical Name:
(R)-3-(3-fluoro-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)-5-(hydroxyMethyl)oxazolidin-2-one
CAS Number:
504438-22-6
Molecular Formula:
C16H21BFNO5
Molecular Weight:
337.1510
IUPAC Name:
(5R)-3-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C16H21BFNO5/c1-15(2)16(3,4)24-17(23-15)12-6-5-10(7-13(12)18)19-8-11(9-20)22-14(19)21/h5-7,11,20H,8-9H2,1-4H3/t11-/m1/s1
InChI Key:
LYCITGUZCIFODE-LLVKDONJSA-N
SMILES:
OC[C@@H]1OC(=O)N(C1)c1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
337.15g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
337.154g/mol
Monoisotopic Mass:
337.15g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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