AG00D1NS

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COA

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CAS Number	34553-37-2
Catalog Number	AG00D1NS(AGN-PC-0NBWJW)
Chemical Name	methyl 5-methyl-4-oxohexanoate
IUPAC Name	methyl 5-methyl-4-oxohexanoate
InChI	InChI=1S/C8H14O3/c1-6(2)7(9)4-5-8(10)11-3/h6H,4-5H2,1-3H3
InChI Key	HQESBEBOAFJVCN-UHFFFAOYSA-N
MDL Number	MFCD16068142
Molecular Formula	C8H14O3
Molecular Weight	158.195
SMILES	COC(CCC(C(C)C)=O)=O
Synonyms	methyl 5-methyl-4-oxohexanoate, 34553-37-2, 4-Oxo-5-methylhexanoic acid methyl ester, SCHEMBL8279035, CTK8I3301, ZINC34540125, AKOS010909921, Z838955646, methyl 5-methyl-4-ketohexanoate, Methyl 5-methyl-4-oxo-hexanoate, 4-Oxo-5-methylhexanoicacidmethylester, CID10866599, Hexanoic acid, 5-methyl-4-oxo-, methyl ester,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.094g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	158.197g/mol
Monoisotopic Mass	158.094g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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