AG00HAA2

Name: Ethyl 2-(2-methylbenzyl)-3-oxobutanoate
Brand: Angene Chemical
SKU: AG00HAA2

104075-51-6 | Ethyl 2-(2-methylbenzyl)-3-oxobutanoate

AG00HAA2

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CAS Number	104075-51-6
Catalog Number	AG00HAA2(AGN-PC-0OSUP8)
Chemical Name	Ethyl 2-(2-methylbenzyl)-3-oxobutanoate
IUPAC Name	ethyl 2-[(2-methylphenyl)methyl]-3-oxobutanoate
InChI	InChI=1S/C14H18O3/c1-4-17-14(16)13(11(3)15)9-12-8-6-5-7-10(12)2/h5-8,13H,4,9H2,1-3H3
InChI Key	XBKZCOOJZSZDOB-UHFFFAOYSA-N
MDL Number	MFCD13249391
Molecular Formula	C14H18O3
Molecular Weight	234.2909
SMILES	C(C(C)=O)(C(OCC)=O)CC1=CC=CC=C1C
Synonyms	ethyl 2-(2-methylbenzyl)-3-oxobutanoate, 104075-51-6, SCHEMBL5329552, XBKZCOOJZSZDOB-UHFFFAOYSA-N, ALBB-021829, ZX-AN037418, MFCD16317678, AKOS015831205, ethyl 2-(o-methylbenzyl)-acetoacetate, MCULE-3656600076, T3979, benzenepropanoic acid, alpha-acetyl-2-methyl-, ethyl ester, ethyl 2-[(2-methylphenyl)methyl]-3-oxobutanoate,

Complexity	273
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.126g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.295g/mol
Monoisotopic Mass	234.126g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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