2-oxo-1,3-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile


Chemical Name: 2-oxo-1,3-dihydropyrrolo[2,3-b]pyridine-5-carbonitrile
CAS Number: 1190321-76-6
Product Number: AG000HZJ(AGN-PC-0H0YM9)
Synonyms:
MDL No:
Molecular Formula: C8H5N3O
Molecular Weight: 159.1448

Identification/Properties


Computed Properties
Molecular Weight:
159.148g/mol
XLogP3:
-0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
159.043g/mol
Monoisotopic Mass:
159.043g/mol
Topological Polar Surface Area:
65.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
254
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback