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Home > Boronic Acids > 339540-17-9
339540-17-9 | [5-Bromo-1-tosylindol-3-yl]boronic acid
CAS No: 339540-17-9 Catalog No: AG00I6PN MDL No:
Product Description
Catalog Number:
AG00I6PN
Chemical Name:
[5-Bromo-1-tosylindol-3-yl]boronic acid
CAS Number:
339540-17-9
IUPAC Name:
[5-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]boronic acid
InChI:
InChI=1S/C15H13BBrNO4S/c1-10-2-5-12(6-3-10)23(21,22)18-9-14(16(19)20)13-8-11(17)4-7-15(13)18/h2-9,19-20H,1H3
InChI Key:
KSSVUAFLFPRHAG-UHFFFAOYSA-N
Properties
Complexity:
518
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.984g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
394.046g/mol
Monoisotopic Mass:
392.984g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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