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159344 Sigma-Aldrich

Ethyl 4-isocyanatobenzoate

97%

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Properties

Related Categories Building Blocks, Chemical Synthesis, Isocyanates, Nitrogen Compounds - Organic Building Blocks, Organic Building Blocks More...
Quality Level   100
assay   97%
bp   118-119 °C/0.8 mmHg (lit.)
mp   27-29 °C (lit.)
storage temp.   2-8°C
SMILES string   CCOC(=O)c1ccc(cc1)N=C=O
InChI   1S/C10H9NO3/c1-2-14-10(13)8-3-5-9(6-4-8)11-7-12/h3-6H,2H2,1H3
InChI key   CFEPCPHKICBCJV-UHFFFAOYSA-N

Description

Application

Ethyl 4-isocyanatobenzoate was used in the preparation of cellulose carbamate and ester derivatives. It was also used in the preparation of ethyl 4-(3-(4-oxo-6-tridecyl-1,4-dihydropyrimidin-2-yl)ureido)benzoate and ethyl 4-(2-oxocyclohexanecarboxamido)benzoate.

Packaging

5, 25 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
Signal word 
Danger
Target organs 
Respiratory system
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
230.0 °F - closed cup
Flash Point(C) 
> 110 °C - closed cup

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Protocols & Articles
Peer-Reviewed Papers
15

References

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