6-Hydroxybenzothiazole - CAS 13599-84-3

Catalog:	BB008265
Product Name:	6-Hydroxybenzothiazole
CAS:	13599-84-3
Synonyms:	1,3-benzothiazol-6-ol; 1,3-benzothiazol-6-ol

Technical Data

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Computed Properties

IUPAC Name:	1,3-benzothiazol-6-ol
Description:	6-Hydroxybenzothiazole (CAS# 13599-84-3) is a useful research chemical.
Molecular Weight:	151.19
Molecular Formula:	C7H5NOS
Canonical SMILES:	C1=CC2=C(C=C1O)SC=N2
InChI:	InChI=1S/C7H5NOS/c9-5-1-2-6-7(3-5)10-4-8-6/h1-4,9H
InChI Key:	ORIIXCOYEOIFSN-UHFFFAOYSA-N
Boiling Point:	311.6 °C at 760 mmHg
Density:	1.444 g/cm³
Solubility:	Other solvents(Soluble) : Methanol
MDL:	MFCD00057883
LogP:	2.00190

Publication Number	Title	Priority Date
CN-113215599-A	Synthesis method of O-phosphino-substituted phenol and alcohol derivative	20210413
WO-2021188667-A1	Targeted degraders of aberrant tau based on the pet tracer pbb3	20200318
KR-20190139189-A	Compounds with high selectivity to tau aggregates, tau-targeting probe comprising the same, and preparation method thereof	20191209
KR-102132847-B1	Compounds with high selectivity to tau aggregates, tau-targeting probe comprising the same, and preparation method thereof	20191209
WO-2021113679-A1	Dimeric compounds as sting agonists	20191206

PMID	Publication Date	Title	Journal
21220550	20110201	A fluorescence-based alkaline phosphatase-coupled polymerase assay for identification of inhibitors of dengue virus RNA-dependent RNA polymerase	Journal of biomolecular screening
19168366	20090401	A simple, versatile, low-cost and remotely operated apparatus for [11C]acetate, [11C]choline, [11C]methionine and [11C]PIB synthesis	Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine
19513419	20090201	Studying the photoprotective activity of a new class of heteroaromatic antioxidants	Bulletin of experimental biology and medicine
16971697	20061114	Voxel-based analysis of PET amyloid ligand [11C]PIB uptake in Alzheimer disease	Neurology

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Complexity:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	151.00918496
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	151.00918496
Rotatable Bond Count:	0
Topological Polar Surface Area:	61.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7