BRUCINE SULFATE HYDRATE ,5787-00-8 _Chemical Cloud Database

BRUCINE SULFATE HYDRATE

Basic Information
Product Name：	BRUCINE SULFATE HYDRATE
CAS：	5787-00-8 ;652154-10-4 ;4845-99-2 ;38741-38-7
English Synonyms：	BRUCINE SULFATE SALT HYDRATE ; BRUCINE SULFATE HYDRATE ; BRUCINE SULFATE N-HYDRATE ; 10,11-DIMETHOXYSTRYCHNINE SULFATE SALT HYDRATE
MDL Number.：	MFCD00150158
H bond acceptor：	6
H bond donor：	0
Smile：	COc1cc2c(cc1OC)N3[C@@H]4[C@]25CCN6[C@H]5C[C@@H]7[C@H]4[C@H](CC3=O)OCC=C7C6.COc1cc2c(cc1OC)N3[C@@H]4[C@]25CCN6[C@H]5C[C@@H]7[C@H]4[C@H](CC3=O)OCC=C7C6.O.OS(=O)(=O)O
InChi：	InChI=1S/2C23H26N2O4.H2O4S.H2O/c21-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;1-5(2,3)4;/h23,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;(H2,1,2,3,4);1H2/t2*13-,18-,19-,21-,22-,23+;;/m00../s1
InChiKey：	InChIKey=DYCXTLLGAUPAQK-YZWZKZGNSA-N
Property
Melting Point：	APPROX 180 DEG C DEC
Comments：	ASSAY METHOD: (DRY WT), WATER <13% ASSAY METHOD: DRY WT EINECS: 225-432-9 HAZARD: R 26/28-52/53 HAZARD: S 13-45-61 HIGHLY TOXIC MERCK: 14,1455 TSCA: N UN NUMBER: UN2811 UNSPSC: 12352005
Safety information
Symbol：	GHS06
Signal word：	Danger
Hazard statements：	H300-H330-H412
Precautionary statements：	P260-P264-P273-P284-P310
hazard symbol：	T+
Risk Code：	R:26/28-52/53
Safe Code：	S:13-45-61
WGK Germany：	3

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