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Diethyl butylmalonate

Basic information Synthesis Safety Supplier Related

Diethyl butylmalonate Basic information

Product Name:
Diethyl butylmalonate
Synonyms:
  • BMDE
  • BUTYLMALONIC ACID DIETHYL ESTER
  • ETHYL BUTYLMALONATE
  • DIETHYL N-BUTYLMALONATE
  • DIETHYL BUTYLMALONATE
  • LABOTEST-BB LTBB001318
  • N-BUTYL DIETHYL MALONATE
  • N-BUTYLMALONIC ACID DIETHYL ESTER
CAS:
133-08-4
MF:
C11H20O4
MW:
216.27
EINECS:
205-089-1
Product Categories:
  • TheMalonateRamificationProducts
  • Pharmaceutical Intermediates
  • C10 to C11
  • Carbonyl Compounds
  • Esters
Mol File:
133-08-4.mol
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Diethyl butylmalonate Chemical Properties

Melting point:
238 °C
Boiling point:
235-240 °C (lit.)
Density 
0.983 g/mL at 25 °C (lit.)
vapor pressure 
1Pa at 20℃
refractive index 
n20/D 1.422(lit.)
Flash point:
201 °F
storage temp. 
Sealed in dry,Room Temperature
solubility 
DMSO : 100 mg/mL (462.38 mM; Need ultrasonic)|
form 
clear liquid
pka
13.47±0.46(Predicted)
Specific Gravity
0.975 (20/4℃)
color 
Colorless to Almost colorless
Water Solubility 
330mg/L at 20℃
Merck 
14,1576
BRN 
608785
LogP
3.4 at 23℃
CAS DataBase Reference
133-08-4(CAS DataBase Reference)
NIST Chemistry Reference
Diethyl butylmalonate(133-08-4)
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Safety Information

Safety Statements 
24/25
WGK Germany 
1
HS Code 
29171990

MSDS

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Diethyl butylmalonate Usage And Synthesis

Synthesis

Diethyl malonate is mixed with sodium ethoxide, and then chlorobutane is added to form the reaction. The crude product is separated and recovered ethanol, washed and dehydrated to obtain Diethyl butylmalonate.

Chemical Properties

CLEAR COLOURLESS LIQUID

Uses

Diethyl butylmalonate is used as a reagent in the synthesis of 2,5-dihydropyrrole formyl hydroxyamino derivatives as peptide deformylase inhibitors against drug-resistant bacteria.

Synthesis Reference(s)

Organic Syntheses, Coll. Vol. 1, p. 250, 1941
The Journal of Organic Chemistry, 44, p. 3492, 1979 DOI: 10.1021/jo01334a009

General Description

Diethyl malonate (DEM) undergoes alkylation by ethyliodide, which is used to study the phase transfer catalysis (PTC) technique.

Flammability and Explosibility

Not classified

Diethyl butylmalonate Preparation Products And Raw materials

Raw materials

Preparation Products

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