BRUCINE SULFATE HEPTAHYDRATE

CAS No.
5787-00-8 ;60583-39-3
CCD No.
CCD00074383
Formula
2 C23 H26 N2 O4 . 7 H2 O . H2 O4 S
MolWeight
1013.12

Basic Information

Product Name: BRUCINE SULFATE HEPTAHYDRATE
CAS: 5787-00-8 ;60583-39-3
English Synonyms: BRUCINE SULPHATE HEPTAHYDRATE ; 2,3-DIMETHOXYSTRYCHNIDIN-10-ONE SULFATE HEPTAHYDRATE ; BRUCINE SULFATE ; 10,11-DIMETHOXYSTRYCHINE SULFATE SALT HYDRATE ; BRUCINE SULFATE SALT HYDRATE ; BRUCINE SULFATE, 7-HYDRATE ; BRUCINE SULFATE HEPTAHYDRATE
MDL Number.: MFCD00150159
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.O.O.O.O.O.O.OS(=O)(=O)O
InChi: InChI=1S/2C23H26N2O4.H2O4S.7H2O/c2*1-27-16-8-14-15(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;;;;;;;/h2*3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;(H2,1,2,3,4);7*1H2/t2*13-,18-,19-,21-,22-,23+;;;;;;;;/m00......../s1
InChiKey: InChIKey=PPJIVFYMRNHHTJ-JYGVWXPPSA-N

Property

Comments: UN1570
Specification: GUARANTEED REAGENT

Safety information

Symbol: GHS06 GHS06
Signal word: Danger
Hazard statements: H300 + H330-H412
Precautionary statements: P260-P264-P273-P284-P301 + P310-P310
hazard symbol: T+
Risk Code: R:26/28-52/53
Safe Code: S:13-45-61
WGK Germany: 3

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