2,1,3-Benzoxadiazol-5-ol


Chemical Name: 2,1,3-Benzoxadiazol-5-ol
CAS Number: 768-09-2
Product Number: AG005I8A(AGN-PC-0OHW2G)
Synonyms:
MDL No:
Molecular Formula: C6H4N2O2
Molecular Weight: 136.1082

Identification/Properties


Properties
MP:
103℃
Form:
Solid
Computed Properties
Molecular Weight:
136.11g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
136.027g/mol
Monoisotopic Mass:
136.027g/mol
Topological Polar Surface Area:
59.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
131
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


NMR Spectrum


Other Analytical Data


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