1,2,5-Oxadiazol-3-amine, 4-ethyl-


Chemical Name: 1,2,5-Oxadiazol-3-amine, 4-ethyl-
CAS Number: 763141-02-2
Product Number: AG019UCM(AGN-PC-00ZCJJ)
Synonyms:
MDL No:
Molecular Formula: C4H7N3O
Molecular Weight: 113.1179

Identification/Properties


Computed Properties
Molecular Weight:
113.12g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
113.059g/mol
Monoisotopic Mass:
113.059g/mol
Topological Polar Surface Area:
64.9A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
77.7
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

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NMR Spectrum


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