Skip to Content
Merck
All Photos(2)

Key Documents

View All Documentation

Safety Information

411485

Sigma-Aldrich

Diisopropyl malonate

ReagentPlus®, 99%

Sign Into View Organizational & Contract Pricing
All Photos(2)

About This Item

Linear Formula:
(CH3)2CHO2CCH2CO2CH(CH3)2
CAS Number:
13195-64-7
Molecular Weight:
188.22
EC Number:
236-156-3
MDL number:
MFCD00059359
UNSPSC Code:
12352100
PubChem Substance ID:
24865749
NACRES:
NA.22

Quality Level

100

product line

ReagentPlus®

Assay

99%

form

liquid

refractive index

n20/D 1.412 (lit.)

bp

93-95 °C/12 mmHg (lit.)

density

0.991 g/mL at 25 °C (lit.)

functional group

ester

SMILES string

CC(C)OC(=O)CC(=O)OC(C)C

InChI

1S/C9H16O4/c1-6(2)12-8(10)5-9(11)13-7(3)4/h6-7H,5H2,1-4H3

InChI key

QRVSDVDFJFKYKA-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Related Categories

Application

Diisopropyl malonates may be used in the synthesis of :
  • 3-substituted coumarins
  • 2-carboisopropoxy-3-hydroxyquinoxaline-di-N-oxide
  • 2-carboisopropoxy-3-hydroxy-6-methoxylquinoxaline-di-N-oxide

Legal Information

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

192.2 °F - closed cup

Flash Point(C)

89 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

411485-500ML:
411485-VAR:
411485-100ML:
411485-BULK:

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
STBJ2912
STBG8765
STBB8099V
S37329V
STBB8099

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Use of isopropyl alcohol as a solvent in Ti (O-i-Pr) 4-catalyzed Knoevenagel reactions.
Yamashita K, et al.
Tetrahedron, 61(33), 7981-7985 (2005)
Yingjun Xu et al.
Molecules (Basel, Switzerland), 16(8), 6894-6901 (2011-08-16)
A series of quinoxaline 1,4-di-N-oxide analogues were prepared from benzofurazan N-oxide derivatives and β-diketone ester compounds by the improved Beirut reaction. The structures of the target products were characterized by NMR, MS, IR and elemental analysis measurements, and that of
A Catalytic Enantioselective Michael Addition of a Simple Malonate to Prochiral a, ?-Unsaturated Ketoses and Aldehydes.
Yamaguchi M, et al.
Angewandte Chemie (International Edition in English), 32(8), 1176-1178 (1993)
H Jinno et al.
Archives of toxicology, 71(9), 550-555 (1997-01-01)
The fungicide isoprothiolane (diisopropyl 1,3-dithiolane-2-ylidenemalonate) decomposes to the diisopropyl esters of malonic acid (DM), chloromalonic acid (DCM) and dichloromalonic acid (DDCM) upon aqueous chlorination. In this study, the cytotoxicity of these compounds was examined using rat hepatocytes cultured on Matrigel.

Global Trade Item Number

SKUGTIN
411485-100ML4061832072319
411485-500ML

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service