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Ethyl 2-isopropylacetoacetate

Basic information Safety Supplier Related

Ethyl 2-isopropylacetoacetate Basic information

Product Name:
Ethyl 2-isopropylacetoacetate
Synonyms:
  • 2-Isopropylacetoacetic acid ethyl ester
  • Acetoacetic acid, 2-isopropyl-, ethyl ester
  • Ethyl 2-acetyl-3-methylbutanoate
  • ETHYL-ALPHA-ISOPROPYLACETOACETATE
  • ETHYL A-ISOPROPYLACETOACETATE
  • ETHYL-ISO-PROPYLACETOACETATE
  • ETHYL 2-ISO-PROPYLACETOACETATE
  • 2-Acetyl-3-methylbutyric acid ethyl ester
CAS:
1522-46-9
MF:
C9H16O3
MW:
172.22
EINECS:
216-192-6
Product Categories:
  • C8 to C9
  • Carbonyl Compounds
  • Esters
Mol File:
1522-46-9.mol
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Ethyl 2-isopropylacetoacetate Chemical Properties

Boiling point:
82-85 °C/12 mmHg (lit.)
Density 
0.962 g/mL at 20 °C (lit.)
refractive index 
n20/D 1.425
Flash point:
76 °C
storage temp. 
2-8°C
solubility 
Chloroform, Ethyl Acetate
form 
Oil
pka
12.28±0.46(Predicted)
color 
Clear Colorless
BRN 
636360
LogP
1.584 (est)
CAS DataBase Reference
1522-46-9(CAS DataBase Reference)
NIST Chemistry Reference
Butanoic acid, 2-acetyl-3-methyl-, ethyl ester(1522-46-9)
EPA Substance Registry System
Ethyl 2-isopropylacetoacetate (1522-46-9)
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Safety Information

Safety Statements 
23-24/25
WGK Germany 
3
HS Code 
2918300090

MSDS

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Ethyl 2-isopropylacetoacetate Usage And Synthesis

Description

Ethyl 2-isopropylacetoacetate is a β-keto ester compound with an isopropyl substitution at the α-position between the two carbonyls. It is potentially useful as in synthetic applications as a precursor to α,α-disubstituted β-keto esters, and the α-Me and α-Et analogs have been used in the preparation of stereodefined α,α-disubstituted amino acids.

Uses

Ethyl 2-Isopropylacetoacetate is a reactant in the preparation of nonracemic arylhydroxymethylpyrrolidinylmethylphenyl thiazoleacetamides and cyclopentathiazolecarboxamides as conformationally restricted β3-adrenoceptor agonists as a potential treatment for overactive bladder.

Ethyl 2-isopropylacetoacetate Preparation Products And Raw materials

Preparation Products

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