3-Pyridinecarbonitrile,5-chloro-1,6-dihydro-6-oxo-


Chemical Name: 3-Pyridinecarbonitrile,5-chloro-1,6-dihydro-6-oxo-
CAS Number: 19840-46-1
Product Number: AG002BHQ(AGN-PC-0QPTTL)
Synonyms:
MDL No:
Molecular Formula: C6H3ClN2O
Molecular Weight: 154.5538

Identification/Properties


Computed Properties
Molecular Weight:
154.553g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
153.993g/mol
Monoisotopic Mass:
153.993g/mol
Topological Polar Surface Area:
52.9A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
281
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-H312-H332
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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