6-HYDROXY-1,3-BENZOXATHIOL-2-ONE ,4991-65-5

6-HYDROXY-1,3-BENZOXATHIOL-2-ONE

Basic Information
Product Name：	6-HYDROXY-1,3-BENZOXATHIOL-2-ONE
CAS：	4991-65-5
English Synonyms：	6-HYDROXY-2H-1,3-BENZOXATHIOL-2-ONE ; 6-HYDROXY-1,3-BENZOXANTHIOL-2-ONE ; 6-HYDROXY-BENZO[1,3]OXATHIOL-2-ONE ; TIOXOLONE ; 6-HYDROXYBENZO[D][1,3]OXATHIOL-2-ONE ; 6-HYDROXY-1,3-BENZOXATHIOL-2-ONE ; THIOXOLONE
MDL Number.：	MFCD00005859
H bond acceptor：	3
H bond donor：	1
Smile：	c1cc2c(cc1O)oc(=O)s2
InChi：	InChI=1S/C7H4O3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3,8H
InChiKey：	InChIKey=SLYPOVJCSQHITR-UHFFFAOYSA-N
Property
Melting Point：	158-160 DEG C(LIT)
Comments：	OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. 217077.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN RTECS: DM2953750 UNSPSC: 12352100 WGK: 3
Safety information
Symbol：	GHS07
Signal word：	Warning
Hazard statements：	H302-H315-H319-H335
Precautionary statements：	P261-P305 + P351 + P338
WGK Germany：	3

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