AG00575Y

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CAS Number	82547-30-6
Catalog Number	AG00575Y(AGN-PC-03PXKE)
Chemical Name	Benzenepropanoic acid, 5-bromo-2-methoxy-
IUPAC Name	3-(5-bromo-2-methoxyphenyl)propanoic acid
InChI	InChI=1S/C10H11BrO3/c1-14-9-4-3-8(11)6-7(9)2-5-10(12)13/h3-4,6H,2,5H2,1H3,(H,12,13)
InChI Key	RCLIOLQUIYTUPY-UHFFFAOYSA-N
MDL Number	MFCD09258907
Molecular Formula	C10H11BrO3
Molecular Weight	259.0965
SMILES	O=C(O)CCC1=CC(Br)=CC=C1OC
Synonyms	3-(5-bromo-2-methoxyphenyl)propanoic acid, 82547-30-6, Benzenepropanoic acid, 5-bromo-2-methoxy-, MFCD09258907, SCHEMBL7994543, CTK3E6205, DTXSID40627573, RCLIOLQUIYTUPY-UHFFFAOYSA-N, GEO-03670, STL216032, ZINC11803917, AKOS002339365, MCULE-4385883792, NE35485, 3-(5-Bromo-2-methoxyphenyl)propionic acid, 3-(5-bromo-2-methoxyphenyl) propanoic acid, ST45239198, 3-(5-Bromo-2-methoxy-phenyl)-propionic acid, EN300-82786, VU0549415-1, F9995-0934, Z1213721933,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.989g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	259.099g/mol
Monoisotopic Mass	257.989g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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