DIFLUNISAL ,22494-42-4 _Chemical Cloud Database

DIFLUNISAL

Basic Information
Product Name：	DIFLUNISAL
CAS：	22494-42-4
English Synonyms：	5-[2,4-DIFLUOROPHENYL]SALICYLIC ACID ; 2',4'-DIFLUORO-4-HYDROXY[1,1'-BIPHENYL]-3-CARBOXYLIC ACID ; 2',4'-DIFLUORO-4-HYDROXY-BIPHENYL-3-CARBOXYLIC ACID ; 4',6'-DIFLUORO-4-HYDROXYBIPHENYL-3-CARBOXYLIC ACID ; 5-(2,4-DIFLUOROPHENYL)-2-HYDROXYBENZOIC ACID ; DIFLUSINAL ; DIFLUNISAL
MDL Number.：	MFCD00057834
H bond acceptor：	3
H bond donor：	2
Smile：	c1cc(c(cc1c2ccc(cc2F)F)C(=O)O)O
InChi：	InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)
InChiKey：	InChIKey=HUPFGZXOMWLGNK-UHFFFAOYSA-N
Property
Comments：	OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF D3281. PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN RTECS: DV2030000 UNSPSC: 51000000 WGK: 3
Specification：	ANALYTICAL STANDARD
Safety information
Symbol：	GHS07 GHS08
Signal word：	Warning
Hazard statements：	H302-H315-H319-H335-H361
Precautionary statements：	P261-P281-P305 + P351 + P338
hazard symbol：	Xn
Risk Code：	R:63-22-36/37/38
Safe Code：	S:22-26-36
WGK Germany：	3

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