AG01C737

Name: 1,1-dioxo-3,4-dihydro-2H-1lambda6-thiopyran-5-carboxylic acid
Brand: Angene Chemical
SKU: AG01C737

99418-18-5 | 1,1-dioxo-3,4-dihydro-2H-1lambda6-thiopyran-5-carboxylic acid

AG01C737

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CAS Number	99418-18-5
Catalog Number	AG01C737
Chemical Name	1,1-dioxo-3,4-dihydro-2H-1lambda6-thiopyran-5-carboxylic acid
IUPAC Name	1,1-dioxo-3,4-dihydro-2H-thiopyran-5-carboxylic acid
InChI	InChI=1S/C6H8O4S/c7-6(8)5-2-1-3-11(9,10)4-5/h4H,1-3H2,(H,7,8)
InChI Key	QXWCCUNTWLGBAB-UHFFFAOYSA-N
MDL Number	MFCD20646297
Molecular Formula	C6H8O4S
Molecular Weight	176.1903
SMILES	OC(C1CCCS(=O)(=O)C=1)=O
Synonyms	1,1-dioxo-3,4-dihydro-2H-1lambda6-thiopyran-5-carboxylic acid, 99418-18-5,

Complexity	293
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