AG00DC03

Name: Dimethyl 3-oxoadipate
Brand: Angene Chemical
SKU: AG00DC03

5457-44-3 | Dimethyl 3-oxoadipate

AG00DC03

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CAS Number	5457-44-3
Catalog Number	AG00DC03(AGN-PC-0JLS35)
Chemical Name	Dimethyl 3-oxoadipate
EC Number	226-716-5
IUPAC Name	dimethyl 3-oxohexanedioate
InChI	InChI=1S/C8H12O5/c1-12-7(10)4-3-6(9)5-8(11)13-2/h3-5H2,1-2H3
InChI Key	CMGTZMRSJJKAPM-UHFFFAOYSA-N
MDL Number	MFCD00008467
Molecular Formula	C8H12O5
Molecular Weight	188.1779
NSC Number	24878
SMILES	COC(=O)CCC(=O)CC(=O)OC
Synonyms	Dimethyl 3-oxoadipate, 5457-44-3, Dimethyl 3-oxohexanedioate, Hexanedioic acid, 3-oxo-, dimethyl ester, CMGTZMRSJJKAPM-UHFFFAOYSA-N, EINECS 226-716-5, dimethyl 3-oxo-adipate, dimethyl beta-oxoadipate, Dimethyl \|A-ketoadipate, dimethyl beta-ketoadipate, AC1L2XNF, AC1Q5GV9, Dimethyl 3-oxohexanedioate #, CHEMBL478572, SCHEMBL6560703, 3-Oxoadipic acid dimethyl ester, CTK5A1736, DTXSID70202993, NSC24878, ZINC1615350, 3-ketohexanedioic acid dimethyl ester, NSC-24878, 3-oxo-hexanedioic acid dimethyl ester, 3-Oxohexanedioic acid, dimethyl ester, AKOS006230280, CC-26909, CJ-26082, DB-071872, FT-0625059, Hexanedioic acid,3-oxo-, 1,6-dimethyl ester, C-34585, DIMETHYL3-OXOADIPATE, CID79561, AR-1I5538, C8-H12-O5, 56283-68-2,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.068g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.179g/mol
Monoisotopic Mass	188.068g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	69.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

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