3-Isoxazolamine, 5-methoxy-


Chemical Name: 3-Isoxazolamine, 5-methoxy-
CAS Number: 32326-25-3
Product Number: AG007GSQ(AGN-PC-0NECFE)
Synonyms:
MDL No: MFCD09701967
Molecular Formula: C4H6N2O2
Molecular Weight: 114.1026

Identification/Properties


Computed Properties
Molecular Weight:
114.104g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
114.043g/mol
Monoisotopic Mass:
114.043g/mol
Topological Polar Surface Area:
61.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
78.4
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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