3-Pyridinecarbonitrile, 5-amino-


Chemical Name: 3-Pyridinecarbonitrile, 5-amino-
CAS Number: 13600-47-0
Product Number: AG003MDV(AGN-PC-03OZOX)
Synonyms:
MDL No: MFCD07367907
Molecular Formula: C6H5N3
Molecular Weight: 119.1240

Identification/Properties


Properties
MP:
125 - 127.5 °C
BP:
349.3°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
119.127g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
119.048g/mol
Monoisotopic Mass:
119.048g/mol
Topological Polar Surface Area:
62.7A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
135
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-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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