4,6-Dichloronicotinonitrile


Chemical Name: 4,6-Dichloronicotinonitrile
CAS Number: 166526-03-0
Product Number: AG001WSZ(AGN-PC-0O4QB2)
Synonyms:
MDL No: MFCD08276124
Molecular Formula: C6H2Cl2N2
Molecular Weight: 172.9995

Identification/Properties


Properties
MP:
133-135 °C
BP:
272.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
172.996g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
171.96g/mol
Monoisotopic Mass:
171.96g/mol
Topological Polar Surface Area:
36.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
162
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-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


PNMR/46-Dichloronicotinonitrile-166526-03-0-hnmr.pdf

Other Analytical Data


POTHER/46-Dichloro-nicotinonitrile-166526-03-0-hplc.pdf

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