AG01AIQ7

Name: 1-ethyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-one
Brand: Angene Chemical
SKU: AG01AIQ7

866472-53-9 | 1-ethyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-one

AG01AIQ7

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CAS Number	866472-53-9
Catalog Number	AG01AIQ7(AGN-PC-08YS6P)
Chemical Name	1-ethyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-one
IUPAC Name	2-ethyl-5-(trifluoromethyl)-4H-pyrazol-3-one
InChI	InChI=1S/C6H7F3N2O/c1-2-11-5(12)3-4(10-11)6(7,8)9/h2-3H2,1H3
InChI Key	NESMTDYSHSBSJX-UHFFFAOYSA-N
MDL Number	MFCD12026378
Molecular Formula	C6H7F3N2O
Molecular Weight	180.1278
SMILES	CCN1C(=O)CC(C(F)(F)F)=N1
Synonyms	866472-53-9, 1-ethyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-one, 2-Ethyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one, 1-Ethyl-3-(trifluoromethyl)-1H-pyrazol-5(4H)-one, SCHEMBL1461002, CTK6F0392, KS-00003TAG, 1037AF, SBB055850, ZINC34477532, AKOS008146650, MCULE-9760921134, NE24708, TS-02512, EN300-78720, 1-ethyl-3-(trifluoromethyl)-2-pyrazolin-5-one, Z1268152398, C6H7F3N2O,

Complexity	233
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.051g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	180.13g/mol
Monoisotopic Mass	180.051g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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