2-Butenedinitrile, 2,3-diamino-, (E)-


Chemical Name: 2-Butenedinitrile, 2,3-diamino-, (E)-
CAS Number: 20344-79-0
Product Number: AG00BP8Q(AGN-PC-0O7AP9)
Synonyms:
MDL No:
Molecular Formula: C4H4N4
Molecular Weight: 108.1014

Identification/Properties


Computed Properties
Molecular Weight:
108.104g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
108.044g/mol
Monoisotopic Mass:
108.044g/mol
Topological Polar Surface Area:
99.6A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
183
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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