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279951 Sigma-Aldrich

5-Methyl-1,3-cyclohexanedione

98%

  • CAS Number 4341-24-6

  • Linear Formula CH3C6H7(=O)2

  • Molecular Weight 126.15

  •  Beilstein/REAXYS Number 1099692

  •  MDL number MFCD00010379

  •  PubChem Substance ID 24856918

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C7 to C8, Carbonyl Compounds, Chemical Synthesis, Ketones,
Quality Level   100
assay   98%
mp   126-130 °C (lit.)
SMILES string   CC1CC(=O)CC(=O)C1
InChI   1S/C7H10O2/c1-5-2-6(8)4-7(9)3-5/h5H,2-4H2,1H3
InChI key   DMIIMPQQPXUKOO-UHFFFAOYSA-N

Description

Application

5-Methyl-1,3-cyclohexanedione has been used in the synthesis of:
• racemic (±)-fawcettimine
• 3,6-dimethyl-2-phenylsulfanyl-3,5,6,7-tetrahydro-2H-benzofuran-4-one

Packaging

5 g in glass bottle

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
Protocols & Articles
Peer-Reviewed Papers
15

References

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