1H-Pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione,tetrahydro-6-(phenylmethyl)-


Chemical Name: 1H-Pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione,tetrahydro-6-(phenylmethyl)-
CAS Number: 128740-13-6
Product Number: AG000YC8(AGN-PC-0PIUE3)
Synonyms:
MDL No:
Molecular Formula: C14H16N2O2
Molecular Weight: 244.2890

Identification/Properties


Computed Properties
Molecular Weight:
244.294g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
244.121g/mol
Monoisotopic Mass:
244.121g/mol
Topological Polar Surface Area:
49.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
350
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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