3-Pyridinecarbonitrile, 2-chloro-4-methoxy-


Chemical Name: 3-Pyridinecarbonitrile, 2-chloro-4-methoxy-
CAS Number: 98645-43-3
Product Number: AG006R3W(AGN-PC-0K5NVX)
Synonyms:
MDL No:
Molecular Formula: C7H5ClN2O
Molecular Weight: 168.5804

Identification/Properties


Properties
MP:
175-176℃(Solv: methanol (67-56-1))
BP:
318.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Stability:
Air Sensitive
Computed Properties
Molecular Weight:
168.58g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
168.009g/mol
Monoisotopic Mass:
168.009g/mol
Topological Polar Surface Area:
45.9A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
177
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


NMR Spectrum


Other Analytical Data


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