Isoxazole, 4-methyl-


Chemical Name: Isoxazole, 4-methyl-
CAS Number: 6454-84-8
Product Number: AG00EDCT(AGN-PC-0NHY0K)
Synonyms:
MDL No:
Molecular Formula: C4H5NO
Molecular Weight: 83.0886

Identification/Properties


Properties
BP:
123.898°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
83.09g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
83.037g/mol
Monoisotopic Mass:
83.037g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
46.8
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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