5-Isoxazolemethanamine, 3-ethyl-


Chemical Name: 5-Isoxazolemethanamine, 3-ethyl-
CAS Number: 145689-96-9
Product Number: AG001DB3(AGN-PC-0LU53V)
Synonyms:
MDL No:
Molecular Formula: C6H10N2O
Molecular Weight: 126.1564

Identification/Properties


Computed Properties
Molecular Weight:
126.159g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
126.079g/mol
Monoisotopic Mass:
126.079g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
87.1
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:
Signal Word:
Danger
UN#:
2735
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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