AG01ALQB

Name: Methyl 2-hydroxy-4-(methylsulfanyl)butanoate
Brand: Angene Chemical
SKU: AG01ALQB

52703-96-5 | Methyl 2-hydroxy-4-(methylsulfanyl)butanoate

AG01ALQB

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CAS Number	52703-96-5
Catalog Number	AG01ALQB(AGN-PC-00G77D)
Chemical Name	Methyl 2-hydroxy-4-(methylsulfanyl)butanoate
IUPAC Name	methyl 2-hydroxy-4-methylsulfanylbutanoate
InChI	InChI=1S/C6H12O3S/c1-9-6(8)5(7)3-4-10-2/h5,7H,3-4H2,1-2H3
InChI Key	ZNICVDUAZVFBFJ-UHFFFAOYSA-N
MDL Number	MFCD16693854
Molecular Formula	C6H12O3S
Molecular Weight	164.2227
SMILES	COC(C(CCSC)O)=O
Synonyms	52703-96-5, methyl 2-hydroxy-4-(methylsulfanyl)butanoate, Butanoic acid, 2-hydroxy-4-(methylthio)-, methyl ester, SCHEMBL3928355, CTK1G2254, DTXSID00437433, ZNICVDUAZVFBFJ-UHFFFAOYSA-N, AKOS011496090, J3.606.630J, Racemic Methyl 2-Hydroxy-4-(methylthio)butyrate, 2-Hydroxy-4-(methylthio)butyric acid methyl ester, 2-Hydroxy-4-methylmercaptobutyric acid, Methyl Ester, CID10261421, Methyl 2-hydroxy-4-methylsulfanyl-butanoate,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.051g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.219g/mol
Monoisotopic Mass	164.051g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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