DIACEREIN ,13739-02-1 _Chemical Cloud Database

DIACEREIN

Basic Information
Product Name：	DIACEREIN
CAS：	13739-02-1
English Synonyms：	1,8-DIACETOXY-3-CARBOXYANTHRAQUINONE ; 4,5-DIACETOXYANTHRAQUINONE-2-CARBOXYLIC ACID ; DIACETYL RHEIN ; DIACERHEIN ; DIACEREIN ; 4,5-DIACETOXY-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLIC ACID ; 4,5-BIS(ACETYLOXY)-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLIC ACID
MDL Number.：	MFCD00468030
H bond acceptor：	8
H bond donor：	1
Smile：	CC(=O)Oc1cccc2c1C(=O)c3c(cc(cc3OC(=O)C)C(=O)O)C2=O
InChi：	InChI=1S/C19H12O8/c1-8(20)26-13-5-3-4-11-15(13)18(23)16-12(17(11)22)6-10(19(24)25)7-14(16)27-9(2)21/h3-7H,1-2H3,(H,24,25)
InChiKey：	InChIKey=TYNLGDBUJLVSMA-UHFFFAOYSA-N
Property
Melting Point：	217-218 DEG C
Comments：	EINECS: 237-310-2 HAZARD: R 36/37/38 HAZARD: S 26-36 MERCK: 14,2960 RTECS: CB8781000 TSCA: N UNSPSC: 12000000
Safety information
Symbol：	GHS07
Signal word：	Warning
Hazard statements：	H315,H319,H335
Precautionary statements：	P261,P305+P351+P338
hazard symbol：	Xi
Risk Code：	R:36/37/38
Safe Code：	S:26,36
WGK Germany：	3

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