1H-Benzotriazol-4-ol


Chemical Name: 1H-Benzotriazol-4-ol
CAS Number: 26725-51-9
Product Number: AG003LJ8(AGN-PC-0O8G2O)
Synonyms:
MDL No:
Molecular Formula: C6H5N3O
Molecular Weight: 135.1234

Identification/Properties


Properties
MP:
224 °C (dec.)
Storage:
-10 ℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
135.126g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
135.043g/mol
Monoisotopic Mass:
135.043g/mol
Topological Polar Surface Area:
61.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
130
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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