1H-Pyrrolo[2,3-b]pyridine-2,3-dione, 5-bromo-


Chemical Name: 1H-Pyrrolo[2,3-b]pyridine-2,3-dione, 5-bromo-
CAS Number: 149142-67-6
Product Number: AG001LF4(AGN-PC-09Q61H)
Synonyms:
MDL No:
Molecular Formula: C7H3BrN2O2
Molecular Weight: 227.0149

Identification/Properties


Computed Properties
Molecular Weight:
227.017g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
225.938g/mol
Monoisotopic Mass:
225.938g/mol
Topological Polar Surface Area:
59.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
244
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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