5-Isoxazolamine, 3-phenyl-


Chemical Name: 5-Isoxazolamine, 3-phenyl-
CAS Number: 4369-55-5
Product Number: AG007355(AGN-PC-0JNWHJ)
Synonyms:
MDL No:
Molecular Formula: C9H8N2O
Molecular Weight: 160.1726

Identification/Properties


Computed Properties
Molecular Weight:
160.176g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
160.064g/mol
Monoisotopic Mass:
160.064g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
146
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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