AG01AJW5

Name: Ethyl 2,4-dioxo-4-[3-(trifluoromethyl)phenyl]butanoate
Brand: Angene Chemical
SKU: AG01AJW5

737772-45-1 | Ethyl 2,4-dioxo-4-[3-(trifluoromethyl)phenyl]butanoate

AG01AJW5

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CAS Number	737772-45-1
Catalog Number	AG01AJW5(AGN-PC-0U3VDQ)
Chemical Name	Ethyl 2,4-dioxo-4-[3-(trifluoromethyl)phenyl]butanoate
IUPAC Name	ethyl 2,4-dioxo-4-[3-(trifluoromethyl)phenyl]butanoate
InChI	InChI=1S/C13H11F3O4/c1-2-20-12(19)11(18)7-10(17)8-4-3-5-9(6-8)13(14,15)16/h3-6H,2,7H2,1H3
InChI Key	SMRXWQFVAQRZKU-UHFFFAOYSA-N
MDL Number	MFCD11046244
Molecular Formula	C13H11F3O4
Molecular Weight	288.2192
SMILES	O=C(CC(=O)C1=CC(=CC=C1)C(F)(F)F)C(=O)OCC
Synonyms	737772-45-1, ethyl 2,4-dioxo-4-[3-(trifluoromethyl)phenyl]butanoate, Ethyl a,g-dioxo-3-trifluoromethylbenzenebutanoate, SCHEMBL10957817, SMRXWQFVAQRZKU-UHFFFAOYSA-N, ethyl 3-trifluoromethylbenzoylpyruvate, AKOS000210592, ZINC100025921, NE23542, EN300-82059,

Complexity	390
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	288.061g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	288.222g/mol
Monoisotopic Mass	288.061g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	60.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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