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


Chemical Name: 1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-
CAS Number: 757978-33-9
Product Number: AG003MFP(AGN-PC-04Q69X)
Synonyms:
MDL No:
Molecular Formula: C8H5BrN2O
Molecular Weight: 225.0421

Identification/Properties


Properties
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
225.045g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
223.959g/mol
Monoisotopic Mass:
223.959g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
188
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:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


PNMR/5-bromo-1H-pyrrolo23-bpyridine-3-carbaldehyde-757978-33-9-hnmr.pdf

Other Analytical Data


POTHER/5-bromo-1H-pyrrolo23-bpyridine-3-carbaldehyde-757978-33-9-hplc.pdf

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