AG005SD2

99429-78-4 | 4-Hydroxythieno[2,3-b]pyridin-6(7H)-one

AG005SD2

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CAS Number	99429-78-4
Catalog Number	AG005SD2(AGN-PC-0AKQ43)
Chemical Name	4-Hydroxythieno[2,3-b]pyridin-6(7H)-one
IUPAC Name	4-hydroxy-7H-thieno[2,3-b]pyridin-6-one
InChI	InChI=1S/C7H5NO2S/c9-5-3-6(10)8-7-4(5)1-2-11-7/h1-3H,(H2,8,9,10)
InChI Key	WZKFAAIOEBUBFO-UHFFFAOYSA-N
MDL Number	MFCD08703241
Molecular Formula	C7H5NO2S
Molecular Weight	167.1851
SMILES	OC1C2=C(SC=C2)NC(=O)C=1
Synonyms	4-Hydroxythieno[2,3-b]pyridin-6(7H)-one, 99429-78-4, THIENO[2,3-B]PYRIDINE-4,6-DIOL, 6-Hydroxythieno[2,3-b]pyridin-4(7H)-one, 4-hydroxy-6H,7H-thieno[2,3-b]pyridin-6-one, 1822942-47-1, Thieno[2,3-b]pyridin-6(7H)-one, 4-hydroxy-, SCHEMBL7308544, CTK5I0406, DTXSID50716402, ANW-56942, MFCD08703241, ZINC34068796, AKOS006341667, AKOS030624060, AB56046, AJ-86747, AK-99918, DS-17756, 4-hydroxy-7h-thieno[2,3-b]pyridin-6-one, Z2588063704, 4-HYDROXYTHIENO[2,3-B]PYRIDIN-6 -ONE, N/A,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.004g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	167.182g/mol
Monoisotopic Mass	167.004g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	77.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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