AG003PLP

Name: Dimethyl Benzylmalonate
Brand: Angene Chemical
SKU: AG003PLP

49769-78-0 | Dimethyl Benzylmalonate

AG003PLP

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CAS Number	49769-78-0
Catalog Number	AG003PLP(AGN-PC-0NCI48)
Chemical Name	Dimethyl Benzylmalonate
IUPAC Name	dimethyl 2-benzylpropanedioate
InChI	InChI=1S/C12H14O4/c1-15-11(13)10(12(14)16-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChI Key	ZMYJSOIMFGAQRQ-UHFFFAOYSA-N
MDL Number	MFCD01445471
Molecular Formula	C12H14O4
Molecular Weight	222.2372
SMILES	COC(=O)C(CC1=CC=CC=C1)C(=O)OC
Synonyms	Dimethyl Benzylmalonate, 49769-78-0, ACMC-209ki3, 2-Benzylmalonic acid dimethyl, SCHEMBL1442737, CTK4J1661, Benzylmalonic Acid Dimethyl Ester, DTXSID50447744, ZINC2379988, 0091AC, 2-Benzyl-malonic acid dimethyl ester, ANW-30841, MFCD01445471, AKOS015915521, BENZYLMALONIC ACID METHYL ESTER, ACM49769780, AJ-34648, AS-10010, TC-119586, D3432, FT-0754104, I14-6126, Propanedioic acid,2-(phenylmethyl)-, 1,3-dimethyl ester, Propanedioic acid,2-(phenylmethyl)-,1,3-dimethyl ester, Dimethyl 2-benzylmalonate, Dimethylbenzylmalonate, Dimethyl 2-benzylpropanedioate, C12H14O4, CID10900856, 65749-05-5, 52267-39-7,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.089g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.24g/mol
Monoisotopic Mass	222.089g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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