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1159512-28-3 | Sulfur, (3-bromo-4-hydroxy-5-nitrophenyl)pentafluoro-, (OC-6-21)-
CAS No: 1159512-28-3 Catalog No: AG000H74 MDL No:
Product Description
Catalog Number:
AG000H74
Chemical Name:
Sulfur, (3-bromo-4-hydroxy-5-nitrophenyl)pentafluoro-, (OC-6-21)-
CAS Number:
1159512-28-3
IUPAC Name:
2-bromo-6-nitro-4-(pentafluoro-λ6-sulfanyl)phenol
InChI:
InChI=1S/C6H3BrF5NO3S/c7-4-1-3(17(8,9,10,11)12)2-5(6(4)14)13(15)16/h1-2,14H
InChI Key:
DBQXYFIOJPTQCK-UHFFFAOYSA-N
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.894g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.05g/mol
Monoisotopic Mass:
342.894g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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