AG00C076

Name: Propanoic acid,2-mercapto-2-methyl-, ethyl ester
Brand: Angene Chemical
SKU: AG00C076

33441-50-8 | Propanoic acid,2-mercapto-2-methyl-, ethyl ester

AG00C076

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CAS Number	33441-50-8
Catalog Number	AG00C076(AGN-PC-000N6Y)
Chemical Name	Propanoic acid,2-mercapto-2-methyl-, ethyl ester
FEMA Number	4714
IUPAC Name	ethyl 2-methyl-2-sulfanylpropanoate
InChI	InChI=1S/C6H12O2S/c1-4-8-5(7)6(2,3)9/h9H,4H2,1-3H3
InChI Key	BJYGHGCEEJDHDR-UHFFFAOYSA-N
MDL Number	MFCD07636747
Molecular Formula	C6H12O2S
Molecular Weight	148.2233
SMILES	CCOC(=O)C(S)(C)C
Synonyms	33441-50-8, ETHYL 2-MERCAPTO-2-METHYLPROPIONATE, ETHYL 2-METHYL-2-SULFANYLPROPANOATE, 2-Mercapto-2-methyl-propanoic acid ethyl ester, 2-Mercapto-2-methyl-propionic Acid Ethyl Ester, Propanoic acid, 2-mercapto-2-methyl-, ethyl ester, SCHEMBL1975004, CTK4H0591, DTXSID30557097, BJYGHGCEEJDHDR-UHFFFAOYSA-N, ZINC14983127, AKOS006284859, FT-0668313, 2-mercapto-2-methylpropanoic acid ethyl ester, Propanoic acid,2-mercapto-2-methyl-, ethyl ester, J-019188, C6-H12-O2-S, CS-T-22978,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	148.056g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	148.22g/mol
Monoisotopic Mass	148.056g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	27.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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