3(2H)-Isoxazolone, 5-(aminomethyl)-, monohydrobromide


Chemical Name: 3(2H)-Isoxazolone, 5-(aminomethyl)-, monohydrobromide
CAS Number: 18174-72-6
Product Number: AG00232N(AGN-PC-0QC2D7)
Synonyms:
MDL No:
Molecular Formula: C4H7BrN2O2
Molecular Weight: 195.0146

Identification/Properties


Computed Properties
Molecular Weight:
195.016g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
193.969g/mol
Monoisotopic Mass:
193.969g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
141
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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