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219282 Sigma-Aldrich

(+)-Emetine dihydrochloride hydrate

97%

  • CAS Number 313222-95-6

  • Empirical Formula (Hill Notation) C29H40N2O4 · 2HCl · xH2O

  • Molecular Weight 553.56 (anhydrous basis)

  •  EC Number 206-259-8

  •  PubChem Substance ID 24853118

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Properties

Related Categories Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Complex Molecules
assay   97%
optical activity   [α]25/D +9.0°, c = 1 in H2O
mp   235 °C (dec.) (lit.)
SMILES string   O.Cl.Cl.CC[C@@H]1CN2CCc3cc(OC)c(OC)cc3[C@H]2C[C@H]1C[C@@H]4NCCc5cc(OC)c(OC)cc45
InChI   1S/C29H40N2O4.2ClH.H2O/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24;;;/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3;2*1H;1H2/t18-,21-,24+,25-;;;/m1.../s1
InChI key   IZTPMTAWOCEKKM-MZRUSFJHSA-N

Description

Packaging

5 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS06  GHS06
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN 1544PSN2 6.1 / PGII
WGK Germany 
3
Protocols & Articles
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Description

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E2375 Emetine dihydrochloride hydrate

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