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695580 Sigma-Aldrich

1,3-Butadiene solution

20 wt. % in toluene

  • CAS Number 106-99-0

  • Empirical Formula (Hill Notation) C4H6

  • Molecular Weight 54.09

  •  MDL number MFCD00008659

  •  PubChem Substance ID 329761753

  •  NACRES NA.22

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Properties

Related Categories Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks More...
Quality Level   100
concentration   20 wt. % in toluene
refractive index   n20/D 1.493
density   0.806 g/mL at 25 °C
storage temp.   2-8°C
SMILES string   C=CC=C
InChI   1S/C4H6/c1-3-4-2/h3-4H,1-2H2
InChI key   KAKZBPTYRLMSJV-UHFFFAOYSA-N

Description

Application

1,3-Butadiene can be used:
• In the synthesis of 1,6-hexanedial (adipic aldehyde) by bis-hydroformylation using rhodium as a catalyst.
• As a monomer for the synthesis of cis-1,4-polybutadiene by polymerization using cobalt(II) and nickel(II) complex catalysts.
• As a precursor for the selective synthesis of butene by hydrogenation reaction.

Packaging

250 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
Signal word 
Danger
Target organs 
Central nervous system
RIDADR 
UN 1993BE 3 / PGII
WGK Germany 
WGK 3
Flash Point(F) 
-105.0 °F
Flash Point(C) 
-76.11 °C

Documents

Certificate of Analysis (COA)

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Certificate of Origin (COO)

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Protocols & Articles

Articles

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US EPA Method TO-17: GC Analysis of Volatiles on Equity®-1 after Collection/Desorption using Carbotrap 300 Tube

From our library of Articles, Sigma-Aldrich presents US EPA Method TO-17: GC Analysis of Volatiles on Equity®-1 after Collection/Desorption using Carbotrap 300 Tube
Keywords: Chromatography, Gas chromatography

Peer-Reviewed Papers
15

References

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