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Home > Boronic Acids > 1509932-05-1
1509932-05-1 | 1-{[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzene]sulfonyl}pyrrolidine
CAS No: 1509932-05-1 Catalog No: AG00HXU4 MDL No:MFCD19288882
Product Description
Catalog Number:
AG00HXU4
Chemical Name:
1-{[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzene]sulfonyl}pyrrolidine
CAS Number:
1509932-05-1
Molecular Formula:
C16H24BNO4S
Molecular Weight:
337.2421
MDL Number:
MFCD19288882
IUPAC Name:
1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonylpyrrolidine
InChI:
InChI=1S/C16H24BNO4S/c1-15(2)16(3,4)22-17(21-15)13-8-7-9-14(12-13)23(19,20)18-10-5-6-11-18/h7-9,12H,5-6,10-11H2,1-4H3
InChI Key:
KSYYYRXOMWSFOC-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1cccc(c1)B1OC(C(O1)(C)C)(C)C)N1CCCC1
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.152g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.241g/mol
Monoisotopic Mass:
337.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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