AG00BXDN

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CAS Number	42131-33-9
Catalog Number	AG00BXDN(AGN-PC-0WAKLM)
Chemical Name	1,2,4-Triazol-5-one
IUPAC Name	1,2,4-triazol-3-one
InChI	InChI=1S/C2HN3O/c6-2-3-1-4-5-2/h1H
InChI Key	MDTUWBLTRPRXBX-UHFFFAOYSA-N
MDL Number	MFCD01446029
Molecular Formula	C2HN3O
Molecular Weight	83.0488
SMILES	N1=NC(N=C1)=O
Synonyms	1,2,4-Triazol-5-One, 3H-1,2,4-Triazol-3-one, 42131-33-9, 1,2,4-triazol-3-one, C2HN3O, 1,2,4-Triazol- 5-One, 3h-1,2,4-triazole-3-one, CTK1D4549, MDTUWBLTRPRXBX-UHFFFAOYSA-N, ZINC5382426, CT-407, FCH843464, MFCD01446029, AKOS003193940, AJ-53941, SC-49136, FT-0653661, 90582-EP2305640A2, A825778, I14-1939, 4045-72-1, Z-Reagent, CID11073339, Benzyl-4,6-dimethylpyrimidyl-2 -thiol-carbonate, O-BENZYL S-(4,6-DIMETHYL-2-PYRIMIDINYL)CARBONOTHIONATE, 54770-19-3,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	83.012g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	83.05g/mol
Monoisotopic Mass	83.012g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited