AG00VSH7

Name: 3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid
Brand: Angene Chemical
SKU: AG00VSH7

53979-33-2 | 3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid

AG00VSH7

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CAS Number	53979-33-2
Catalog Number	AG00VSH7(AGN-PC-0SG6AX)
Chemical Name	3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid
IUPAC Name	3-(3,4-dimethoxyphenyl)-2-methylpropanoic acid
InChI	InChI=1S/C12H16O4/c1-8(12(13)14)6-9-4-5-10(15-2)11(7-9)16-3/h4-5,7-8H,6H2,1-3H3,(H,13,14)
InChI Key	UDWOGKXUYHXPKV-UHFFFAOYSA-N
MDL Number	MFCD09894714
Molecular Formula	C12H16O4
Molecular Weight	224.2530
SMILES	COC1=C(OC)C=C(CC(C(O)=O)C)C=C1
Synonyms	3-(3,4-dimethoxyphenyl)-2-methylpropanoic acid, 53979-33-2, SCHEMBL9781691, AKOS002392405, AKOS016050916, MCULE-1295564528, NE31239, 2-Methyl-3-(3,4-dimethoxyphenyl)propanoic acid, Benzenepropanoic acid, 3,4-dimethoxy-alpha-methyl-, Z1632890286,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.105g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	224.256g/mol
Monoisotopic Mass	224.105g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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