AG003Q4Q

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CAS Number	487-51-4
Catalog Number	AG003Q4Q(AGN-PC-00PZ8J)
Chemical Name	Ethyl 2-methyl-4-oxocyclohex-2-enecarboxylate
EC Number	207-657-4
IUPAC Name	ethyl 2-methyl-4-oxocyclohex-2-ene-1-carboxylate
InChI	InChI=1S/C10H14O3/c1-3-13-10(12)9-5-4-8(11)6-7(9)2/h6,9H,3-5H2,1-2H3
InChI Key	VLTANIMRIRCCOQ-UHFFFAOYSA-N
MDL Number	MFCD00001582
Molecular Formula	C10H14O3
Molecular Weight	182.2164
NSC Number	60294
SMILES	O=C1C=C(C)C(C(OCC)=O)CC1
Synonyms	487-51-4, Ethyl 2-methyl-4-oxocyclohex-2-enecarboxylate, 4-Carbethoxy-3-methyl-2-cyclohexen-1-one, Hagemann's ester, Ethyl 2-methyl-4-oxo-2-cyclohexenecarboxylate, Ethyl 2-methyl-4-oxo-2-cyclohexencarboxylate, 2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-, ethyl ester, ethyl 2-methyl-4-oxocyclohex-2-ene-1-carboxylate, CHEMBL84047, VLTANIMRIRCCOQ-UHFFFAOYSA-N, 4-Carbethoxy-3-methyl-2-cyclohexene-1-one, 2-Cyclohexene-1-carboxylicacid, 2-methyl-4-oxo-, ethyl ester, Hagemann-Ester, NSC60294, EINECS 207-657-4, ACMC-1ANLF, AC1L2WH7, AC1Q34HZ, AC1Q64AI, SCHEMBL1141761, CTK4J0978, BCP09240, BDBM50078829, MFCD00001582, NSC-60294, AKOS015915880, TRA0073455, AK167105, AS-19704, SC-48133, TC-166917, FT-0721738, Y5032, 2-Cyclohexene-1-carboxylic acid, ethyl ester, Ethyl 2-methyl-4-oxo-2-cyclohexene-1-carboxylate, Ethyl 2-methyl-4-oxo-2-cyclohexene-1-carboxylate #, I14-54262, 2-Methyl-4-oxo-cyclohex-2-enecarboxylic acid ethyl ester, Ethyl 2-methyl-4-oxo-2-cyclohexenecarboxylate, 90%, technical grade, C10H14O3, CID79020, AR-1I8514, ACN-036680, C10-H14-O3, 51222-23-2,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.094g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	182.219g/mol
Monoisotopic Mass	182.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Product Recommendations

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