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diethyl isopropylmalonate - ≥98.0%(GC), high purity , CAS No.759-36-4

COA

Grade & Purity:

≥98%(GC)

Cas Number: 759-36-4
Molecular Weight: 202.25
Beilstein Registry Number: 2(4)2011
MDL number: MFCD00040491
PubChem CID: 12966
PubChem SID: 488181757

In stock

Item Number

D134845

Grouped product items
SKU	Size	Availability	Price
D134845-5ml	5ml	3	$11.90
D134845-10ml	10ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$17.90
D134845-25ml	25ml	3	$32.90
D134845-100ml	100ml	2	$100.90
D134845-500ml	500ml	1	$328.90

View related series

Carboxylate (915) Non heterocyclic block (8163)

Basic Description

Synonyms	AMY10012 \| Propanedioic acid, (1-methylethyl)-, diethyl ester \| AS-59020 \| FT-0624792 \| Ethyl isopropylmalonate \| 2-isopropyl-malonic acid diethyl ester \| NSC 1007 \| Isopropyl diethyl malonate \| AC7748 \| EINECS 212-068-0 \| EN300-52604 \| DIETHYL ISOPROPYLM
Specifications & Purity	≥98%(GC)
Shipped In	Normal
Product Description	Diethyl isopropylmalonate reacts with chalcone by Michael addition, under high pressure and fluoride catalyst, to form compounds having quarternary C atoms. It reacts with chalcone by Michael addition, under high pressure and fluoride catalyst, to form compounds having quarternary C atoms.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Fatty Acyls
    - Subclass Fatty acid esters

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Fatty Acyls
Subclass	Fatty acid esters
Intermediate Tree Nodes	Not available
Direct Parent	Fatty acid esters
Alternative Parents	Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Fatty acid ester - 1,3-dicarbonyl compound - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488181757
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181757
IUPAC Name	diethyl 2-propan-2-ylpropanedioate
INCHI	InChI=1S/C10H18O4/c1-5-13-9(11)8(7(3)4)10(12)14-6-2/h7-8H,5-6H2,1-4H3
InChIKey	BYQFBFWERHXONI-UHFFFAOYSA-N
Smiles	CCOC(=O)C(C(C)C)C(=O)OCC
Isomeric SMILES	CCOC(=O)C(C(C)C)C(=O)OCC
WGK Germany	1
Molecular Weight	202.25
Beilstein	2(4)2011
Reaxy-Rn	1101711
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1101711&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot Number	Certificate Type	Date	Item
F2320167	Certificate of Analysis	Apr 09, 2025	D134845
F2320160	Certificate of Analysis	Apr 09, 2025	D134845
A2213031	Certificate of Analysis	Oct 20, 2023	D134845
G1915177	Certificate of Analysis	Feb 09, 2023	D134845
C2517115	Certificate of Analysis	Jan 05, 2022	D134845
A2224048	Certificate of Analysis	Jan 05, 2022	D134845
A2224040	Certificate of Analysis	Jan 05, 2022	D134845
A2224041	Certificate of Analysis	Jan 05, 2022	D134845
A2224039	Certificate of Analysis	Jan 05, 2022	D134845

Chemical and Physical Properties

Refractive Index	1.42
Flash Point(°F)	197.6 °F
Flash Point(°C)	92°C(lit.)
Boil Point(°C)	214 °C
Molecular Weight	202.250 g/mol
XLogP3	2.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	202.121 Da
Monoisotopic Mass	202.121 Da
Topological Polar Surface Area	52.600 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	180.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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