AG01C07Y

Name: 2-methyl-1,1-dioxo-4,5-dihydro-1lambda6-thiophene-3-carboxylic acid
Brand: Angene Chemical
SKU: AG01C07Y

99418-17-4 | 2-methyl-1,1-dioxo-4,5-dihydro-1lambda6-thiophene-3-carboxylic acid

AG01C07Y

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CAS Number	99418-17-4
Catalog Number	AG01C07Y
Chemical Name	2-methyl-1,1-dioxo-4,5-dihydro-1lambda6-thiophene-3-carboxylic acid
IUPAC Name	5-methyl-1,1-dioxo-2,3-dihydrothiophene-4-carboxylic acid
InChI	InChI=1S/C6H8O4S/c1-4-5(6(7)8)2-3-11(4,9)10/h2-3H2,1H3,(H,7,8)
InChI Key	XAXGGGGBOQHBOV-UHFFFAOYSA-N
MDL Number	MFCD12403643
Molecular Formula	C6H8O4S
Molecular Weight	176.1903
SMILES	CC1S(=O)(=O)CCC=1C(O)=O
Synonyms	99418-17-4, 2-Methyl-1,1-dioxo-4,5-dihydro-1lambda6-thiophene-3-carboxylic acid, ZINC40538948, AKOS022505256, 2-methyl-1,1-dioxo-4,5-dihydro-1lambda-thiophene-3-carboxylic acid,

Complexity	317
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.014g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.186g/mol
Monoisotopic Mass	176.014g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	79.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

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