AG00COTK

Name: 2,4,6-Trimethyl-benzeneacetic acid methyl ester
Brand: Angene Chemical
SKU: AG00COTK

41841-19-4 | 2,4,6-Trimethyl-benzeneacetic acid methyl ester

AG00COTK

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CAS Number	41841-19-4
Catalog Number	AG00COTK
Chemical Name	2,4,6-Trimethyl-benzeneacetic acid methyl ester
IUPAC Name	methyl 2-(2,4,6-trimethylphenyl)acetate
InChI	InChI=1S/C12H16O2/c1-8-5-9(2)11(10(3)6-8)7-12(13)14-4/h5-6H,7H2,1-4H3
InChI Key	SOZFJDHOYOEDBF-UHFFFAOYSA-N
MDL Number	MFCD12024951
Molecular Formula	C12H16O2
Molecular Weight	192.2542
SMILES	O(C)C(CC1C(=CC(=CC=1C)C)C)=O
Synonyms	Methyl 2-mesitylacetate, Methyl Mesitylacetate, 41841-19-4, 2,4,6-Trimethyl-benzeneacetic acid methyl ester, SCHEMBL769278, SOZFJDHOYOEDBF-UHFFFAOYSA-N, ZINC34079594, methyl(2,4,6-trimethylphenyl)acetate, AKOS022342914, methyl (2,4,6-trimethylphenyl)acetate, 2,4,6-Trimethylphenylacetic acid methyl ester, J3.570.770K, 2,4,6-Trimethylbenzeneacetic acid methyl ester, (2,4,6-trimethyl-phenyl)-acetic acid methyl ester, Benzeneacetic acid, 2,4,6-triMethyl-, Methyl ester,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.115g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.258g/mol
Monoisotopic Mass	192.115g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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