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2-Methoxyethyl acetoacetate - 96%, high purity , CAS No.22502-03-0

COA

Grade & Purity:

≥96%

Cas Number: 22502-03-0
Molecular Weight: 160.17
Beilstein Registry Number: 2079850
MDL number: MFCD00009648
PubChem CID: 89734
PubChem SID: 488186565

In stock

Item Number

M109789

Grouped product items
SKU	Size	Availability	Price
M109789-25g	25g	2	$22.90
M109789-100g	100g	5	$82.90
M109789-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$105.90

View related series

Carboxylate (915) Non heterocyclic block (8163)

Basic Description

Synonyms	STL141089 \| FT-0612839 \| F0001-0791 \| SCHEMBL410988 \| DTXSID20177026 \| AMY25617 \| FT-0621770 \| methoxyethyl acetoacetate \| O-ethyl N-phenylcarbamothioate \| Butanoic acid, 3-oxo-, 2-methoxyethyl ester \| SY049972 \| BCP21149 \| 2-Methoxyethylacetoacetate \| 5-
Specifications & Purity	≥96%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Keto acids and derivatives
    - Subclass Beta-keto acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Keto acids and derivatives
Subclass	Beta-keto acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Beta-keto acids and derivatives
Alternative Parents	Fatty acid esters 1,3-dicarbonyl compounds Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Beta-keto acid - Fatty acid ester - 1,3-dicarbonyl compound - Fatty acyl - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.
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	488186565
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488186565
IUPAC Name	2-methoxyethyl 3-oxobutanoate
INCHI	InChI=1S/C7H12O4/c1-6(8)5-7(9)11-4-3-10-2/h3-5H2,1-2H3
InChIKey	PLHCSZRZWOWUBW-UHFFFAOYSA-N
Smiles	CC(=O)CC(=O)OCCOC
Isomeric SMILES	CC(=O)CC(=O)OCCOC
WGK Germany	3
Molecular Weight	160.17
Beilstein	2079850
Reaxy-Rn	2079850
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2079850&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.

5 results found

Lot Number	Certificate Type	Date	Item
G1931010	Certificate of Analysis	May 08, 2023	M109789
H1527037	Certificate of Analysis	Apr 14, 2023	M109789
C2212374	Certificate of Analysis	Feb 19, 2022	M109789
C2212350	Certificate of Analysis	Feb 19, 2022	M109789
C2212352	Certificate of Analysis	Feb 19, 2022	M109789

Chemical and Physical Properties

Sensitivity	Air Sensitive
Refractive Index	1.434
Flash Point(°F)	103 °C
Flash Point(°C)	103°C
Boil Point(°C)	120°C
Molecular Weight	160.170 g/mol
XLogP3	-0.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	160.074 Da
Monoisotopic Mass	160.074 Da
Topological Polar Surface Area	52.600 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	141.000
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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