5-bromo-6-fluoro-1H-indole-2,3-dione


Chemical Name: 5-bromo-6-fluoro-1H-indole-2,3-dione
CAS Number: 118897-99-7
Product Number: AG008TO5(AGN-PC-0161SE)
Synonyms:
MDL No:
Molecular Formula: C8H3BrFNO2
Molecular Weight: 244.0173

Identification/Properties


Computed Properties
Molecular Weight:
244.019g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
242.933g/mol
Monoisotopic Mass:
242.933g/mol
Topological Polar Surface Area:
46.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
271
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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