AG0056VI

Name: (1-Oxy-pyridin-2-ylsulfanyl)-acetic acid
Brand: Angene Chemical
SKU: AG0056VI

83646-04-2 | (1-Oxy-pyridin-2-ylsulfanyl)-acetic acid

AG0056VI

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CAS Number	83646-04-2
Catalog Number	AG0056VI(AGN-PC-0KBPD5)
Chemical Name	(1-Oxy-pyridin-2-ylsulfanyl)-acetic acid
IUPAC Name	2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetic acid
InChI	InChI=1S/C7H7NO3S/c9-7(10)5-12-6-3-1-2-4-8(6)11/h1-4H,5H2,(H,9,10)
InChI Key	OWRBTFBDKKDWIA-UHFFFAOYSA-N
MDL Number	MFCD00214718
Molecular Formula	C7H7NO3S
Molecular Weight	185.2004
SMILES	OC(CSC1=[N+]([O-])C=CC=C1)=O
Synonyms	83646-04-2, 2-[(carboxymethyl)sulfanyl]pyridin-1-ium-1-olate, (1-Oxy-pyridin-2-ylsulfanyl)-acetic acid, Acetic acid, [(1-oxido-2-pyridinyl)thio]-, 2-[(carboxymethyl)sulfanyl]-1-pyridiniumolate, SMR000151484, Bionet2_000168, MLS000536597, AC1M144F, AC1Q769F, SCHEMBL5128185, CHEMBL1489245, CTK2I6149, KS-00001UCZ, DTXSID20366231, HMS1364H14, HMS2416G04, ZINC2558732, MFCD00214718, 2-(Carboxymethylthio)pyridine 1-oxide, AKOS000117087, NE19785, EN300-06228, 2E-083, 2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetic acid, CID2063326,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.015g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	185.197g/mol
Monoisotopic Mass	185.015g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	88.1A^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