4-Isoxazolamine


Chemical Name: 4-Isoxazolamine
CAS Number: 108511-97-3
Product Number: AG008TRL(AGN-PC-00O279)
Synonyms:
MDL No:
Molecular Formula: C3H4N2O
Molecular Weight: 84.0767

Identification/Properties


Computed Properties
Molecular Weight:
84.078g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
84.032g/mol
Monoisotopic Mass:
84.032g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
48.1
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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