3-Isoxazolamine, 4-bromo-5-methyl-


Chemical Name: 3-Isoxazolamine, 4-bromo-5-methyl-
CAS Number: 5819-40-9
Product Number: AG003KZ0(AGN-PC-0KKW6A)
Synonyms:
MDL No:
Molecular Formula: C4H5BrN2O
Molecular Weight: 176.9993

Identification/Properties


Properties
MP:
73-75 °C
BP:
277.6°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
177.001g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
175.959g/mol
Monoisotopic Mass:
175.959g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
90.1
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


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

NMR Spectrum


Other Analytical Data


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