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272051 Sigma-Aldrich

1,3-Di-tert-butylbenzene

97%

  • CAS Number 1014-60-4

  • Linear Formula C6H4[C(CH3)3]2

  • Molecular Weight 190.32

  •  MDL number MFCD00008830

  •  PubChem Substance ID 24856451

  •  NACRES NA.22

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Properties

Related Categories Arenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
Quality Level   100
assay   97%
refractive index   n20/D 1.488 (lit.)
bp   106-107 °C/18 mmHg (lit.)
mp   10-11 °C (lit.)
density   0.859 g/mL at 25 °C (lit.)
SMILES string   CC(C)(C)c1cccc(c1)C(C)(C)C
InChI   1S/C14H22/c1-13(2,3)11-8-7-9-12(10-11)14(4,5)6/h7-10H,1-6H3
InChI key   ILNDSSCEZZFNGE-UHFFFAOYSA-N

Description

General description

The solute-solvent nuclear overhauser effects (NOEs) of 1,3-di-tert-butylbenzene was studied in solvents composed of tetramethylsilane, perfluoro-tert-butyl alcohol and carbon tetrachloride.

Packaging

1 g in glass bottle

Safety & Documentation

Safety Information

WGK Germany 
WGK 3
Flash Point(F) 
183.2 °F - closed cup
Flash Point(C) 
84 °C - closed cup

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Protocols & Articles
Peer-Reviewed Papers
15

References

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