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12268 Sigma-Aldrich

Ethyl benzimidate hydrochloride

≥97.0% (AT)

  • CAS Number 5333-86-8

  • Linear Formula C6H5C(=NH)OCH2CH3 · HCl

  • Molecular Weight 185.65

  •  Beilstein/REAXYS Number 3913195

  •  EC Number 226-248-1

  •  MDL number MFCD00043246

  •  PubChem Substance ID 57646980

  •  NACRES NA.22

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Properties

Related Categories Amidates/Imidates, Building Blocks, Chemical Synthesis, Nitrogen Compounds - Organic Building Blocks, Organic Building Blocks More...
Quality Level   100
assay   ≥97.0% (AT)
mp   ~125 °C (dec.)
SMILES string   Cl[H].CCOC(=N)c1ccccc1
InChI   1S/C9H11NO.ClH/c1-2-11-9(10)8-6-4-3-5-7-8;/h3-7,10H,2H2,1H3;1H
InChI key   MODZVIMSNXSQIH-UHFFFAOYSA-N

Description

General description

Ethyl benzimidate hydrochloride reacts with (R)-ethyl cysteine hydrochloride in ethanol to yield (4R)-ethyl 2-phenyl-4,5-dihydrothiazole-4-carboxylate. It reacts with D-Penicillamine methyl ester hydrochloride and triethylamine to yield methyl-5,5- dimethyl-2-phenyl-2-thiazoline-4-carboxylate.

Packaging

25, 100 g in glass bottle

Application

Intermediate for synthesis

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
Target organs 
Respiratory system
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

Documents

Certificate of Analysis (COA)

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Protocols & Articles
Peer-Reviewed Papers
15

References

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