AG00EBZ8

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CAS Number	5817-92-5
Catalog Number	AG00EBZ8(AGN-PC-0SP7DE)
Chemical Name	2,4-Dioxo-4-phenylbutanoic acid
IUPAC Name	2,4-dioxo-4-phenylbutanoic acid
InChI	InChI=1S/C10H8O4/c11-8(6-9(12)10(13)14)7-4-2-1-3-5-7/h1-5H,6H2,(H,13,14)
InChI Key	JGKFWCXVYCDKDU-UHFFFAOYSA-N
MDL Number	MFCD00456054
Molecular Formula	C10H8O4
Molecular Weight	192.1681
SMILES	O=C(C(=O)O)CC(C1=CC=CC=C1)=O
Synonyms	2,4-dioxo-4-phenylbutanoic acid, DKA acid, 2,4-dioxo-4-phenylbutanoic acid, 5817-92-5, benzoylpyruvic acid, CHEMBL19332, 2-4-Dioxo-4-Phenylbutanoic Acid, AC1LAQSM, CBDivE_002217, SCHEMBL1109671, JGKFWCXVYCDKDU-UHFFFAOYSA-N, 2,4-dioxo-4-phenyl-butanoic acid, ALBB-025921, ZX-AN024433, BDBM50115579, KM3754, MFCD00456054, SBB014905, ZINC12375863, AKOS006274737, MCULE-2511482745, benzenebutanoic acid, alpha,gamma-dioxo-, 2-Hydroxy-4-oxo-4-phenyl-but-2-enoic acid, ST45029085, Benzenebutanoic acid, .alpha.,.gamma.-dioxo-, 2-Hydroxy-4-oxo-4-phenyl-but-2-enoic acid (0.25H2O), CHEMBL16326, CHEMBL467389, AIDS122862, CID493418, (Z)-2-Hydroxy-4-oxo-4-phenyl-but-2-enoic acid, XI7,

Complexity	251
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.042g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	192.17g/mol
Monoisotopic Mass	192.042g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	71.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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