6-Quinolinecarbonitrile, 1,2,3,4-tetrahydro-2-oxo-


Chemical Name: 6-Quinolinecarbonitrile, 1,2,3,4-tetrahydro-2-oxo-
CAS Number: 159053-44-8
Product Number: AG001QFP(AGN-PC-00OOD8)
Synonyms:
MDL No:
Molecular Formula: C10H8N2O
Molecular Weight: 172.1833

Identification/Properties


Computed Properties
Molecular Weight:
172.187g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
172.064g/mol
Monoisotopic Mass:
172.064g/mol
Topological Polar Surface Area:
52.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
265
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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