AG006WRT

SDS

COA

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CAS Number	4850-73-1
Catalog Number	AG006WRT(AGN-PC-0RZV06)
Chemical Name	Methyl 2-(methylsulfinyl)benzoate
IUPAC Name	methyl 2-methylsulfinylbenzoate
InChI	InChI=1S/C9H10O3S/c1-12-9(10)7-5-3-4-6-8(7)13(2)11/h3-6H,1-2H3
InChI Key	OAPYIFWRUTZGOY-UHFFFAOYSA-N
MDL Number	MFCD03844851
Molecular Formula	C9H10O3S
Molecular Weight	198.2389
SMILES	S(=O)(C1(=C(C(=O)OC)C=CC=C1))C
Synonyms	4850-73-1, methyl 2-(methylsulfinyl)benzoate, methyl 2-(methylsulfinyl)benzenecarboxylate, methyl 2-methanesulfinylbenzoate, Methyl 2-methylsulfinylbenzoate, AC1MC918, SCHEMBL8355188, CTK4J0842, KS-00001WMO, DTXSID20377206, Methyl 2-(methanesulfinyl)benzoate, methylmethylsulfinylbenzenecarboxylate, 4189AE, MFCD03844851, SBB092313, AKOS005070514, 4L-615S, ACM4850731, FCH2124985, MCULE-4096864674, RP11646, 2-(Methylsulfinyl)benzoic acid methyl ester, TR-017692, FT-0680374, Benzoic acid,2-[(R)-methylsulfinyl]-, methyl ester, J-521871, I01-13471, C9H10O3S, METHYL2- BENZENECARBOXYLATE, CID2763930,

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.035g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.236g/mol
Monoisotopic Mass	198.035g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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