AG00ENS9

Name: Benzenepropanoic acid, 4-Methyl-, Methyl ester
Brand: Angene Chemical
SKU: AG00ENS9

56955-36-3 | Benzenepropanoic acid, 4-Methyl-, Methyl ester

AG00ENS9

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CAS Number	56955-36-3
Catalog Number	AG00ENS9(AGN-PC-0MUMV2)
Chemical Name	Benzenepropanoic acid, 4-Methyl-, Methyl ester
IUPAC Name	methyl 3-(4-methylphenyl)propanoate
InChI	InChI=1S/C11H14O2/c1-9-3-5-10(6-4-9)7-8-11(12)13-2/h3-6H,7-8H2,1-2H3
InChI Key	ZYODXRYBYZMUNL-UHFFFAOYSA-N
MDL Number	MFCD16663245
Molecular Formula	C11H14O2
Molecular Weight	178.2277
SMILES	O=C(OC)CCC1=CC=C(C)C=C1
Synonyms	56955-36-3, Methyl 3-(p-tolyl)propanoate, methyl 3-(4-methylphenyl)propionate, 4-Methyl-benzenepropanoic acid methyl ester, Benzenepropanoic acid, 4-methyl-, methyl ester, SCHEMBL2569441, CHEMBL2252080, ZYODXRYBYZMUNL-UHFFFAOYSA-N, methyl3-(4-methylphenyl)propanoate, ZINC33992233, 3-p-tolyl-propionic acid methyl ester, AKOS009098717, MCULE-1613073764, 3-(4-Methylphenyl)propanoic acid methyl ester, Methyl 3-(4-methylphenyl)propanoate, CID9855632,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.099g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.231g/mol
Monoisotopic Mass	178.099g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

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