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278041 Sigma-Aldrich

Diethyl tert-butylmalonate

96%

  • CAS Number 759-24-0

  • Linear Formula (CH3)3CCH(COOC2H5)2

  • Molecular Weight 216.27

  •  Beilstein/REAXYS Number 1781709

  •  EC Number 212-067-5

  •  MDL number MFCD00009152

  •  PubChem Substance ID 24856503

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C10 to C11, Carbonyl Compounds, Chemical Synthesis, Esters,
assay   96%
refractive index   n20/D 1.425 (lit.)
bp   102-104 °C/11 mmHg (lit.)
density   1.014 g/mL at 25 °C (lit.)
storage temp.   room temp
SMILES string   CCOC(=O)C(C(=O)OCC)C(C)(C)C
InChI   1S/C11H20O4/c1-6-14-9(12)8(11(3,4)5)10(13)15-7-2/h8H,6-7H2,1-5H3
InChI key   RJNICNBRGVKNSR-UHFFFAOYSA-N

Description

Application

Diethyl tert-butylmalonate has been used in the preparation of enantiomers of 4-tert-butyl-3-isopropyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-sulfide (TBIPPS).

Packaging

5 g in glass bottle

Safety & Documentation

Safety Information

WGK Germany 
WGK 3
Flash Point(F) 
199.4 °F - closed cup
Flash Point(C) 
93 °C - closed cup
Protocols & Articles
Peer-Reviewed Papers
15

References

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