AG002KY7

Name: 3H-Pyrazol-3-one, 1,2-dihydro-1-(1-methylethyl)-
Brand: Angene Chemical
SKU: AG002KY7

21074-39-5 | 3H-Pyrazol-3-one, 1,2-dihydro-1-(1-methylethyl)-

AG002KY7

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COA

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CAS Number	21074-39-5
Catalog Number	AG002KY7(AGN-PC-03VZPC)
Chemical Name	3H-Pyrazol-3-one, 1,2-dihydro-1-(1-methylethyl)-
IUPAC Name	2-propan-2-yl-1H-pyrazol-5-one
InChI	InChI=1S/C6H10N2O/c1-5(2)8-4-3-6(9)7-8/h3-5H,1-2H3,(H,7,9)
InChI Key	MWKDYFHECTXSQY-UHFFFAOYSA-N
MDL Number	MFCD22689772
Molecular Formula	C6H10N2O
Molecular Weight	126.1564
SMILES	OC1=NN(C(C)C)C=C1
Synonyms	1-Isopropyl-1H-pyrazol-3-ol, 21074-39-5, 2-propan-2-yl-1H-pyrazol-5-one, 3H-Pyrazol-3-one, 1,2-dihydro-1-(1-methylethyl)-, N-isopropylpyrazolone, 1-Isopropyl-3-pyrazolone, 1-isopropylhydroxy-pyrazole, SCHEMBL7167339, SCHEMBL10197118, CTK0I9781, DTXSID20628907, MWKDYFHECTXSQY-UHFFFAOYSA-N, CS-B1383, MFCD22689772, ZINC95631112, AKOS030239424, ACN-053332, AS-41028, 1-(Propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.079g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	126.159g/mol
Monoisotopic Mass	126.079g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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