AG00FE30

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CAS Number	672-78-6
Catalog Number	AG00FE30(AGN-PC-0N1X89)
Chemical Name	methyl 4-methylbenzene-1-sulfinate
IUPAC Name	methyl 4-methylbenzenesulfinate
InChI	InChI=1S/C8H10O2S/c1-7-3-5-8(6-4-7)11(9)10-2/h3-6H,1-2H3
InChI Key	MGPLBSPZSIFUQX-UHFFFAOYSA-N
MDL Number	MFCD00198028
Molecular Formula	C8H10O2S
Molecular Weight	170.2288
SMILES	CC1=CC=C(C=C1)S(=O)OC
Synonyms	methyl p-toluenesulfinate, 672-78-6, METHYL 4-METHYLBENZENESULFINATE, methyl 4-methylbenzene-1-sulfinate, METHYLP-TOLUENESULFINATE, (+) Methyl-p-toluenesulfinate, SCHEMBL7717102, (+/-) Methyl-p-toluenesulfinate, MGPLBSPZSIFUQX-UHFFFAOYSA-N, AKOS006273339, 4-Methylbenzenesulfinic acid methyl ester, FT-0695827, 1-methoxysulfinyl-4-methyl-benzene, CID10285823,

Complexity	139
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.04g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.226g/mol
Monoisotopic Mass	170.04g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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