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Methyl 2,2-dimethyl-3-oxobutanoate - 97%, high purity , CAS No.38923-57-8

COA

Grade & Purity:

≥97%

Cas Number: 38923-57-8
Molecular Weight: 144.17
PubChem CID: 96925
PubChem SID: 488187031

In stock

Item Number

M193150

Grouped product items
SKU	Size	Availability	Price
M193150-250mg	250mg	5	$119.90
M193150-1g	1g	5	$233.90
M193150-5g	5g	5	$687.90
M193150-25g	25g	2	$2,747.90

Discover Methyl 2,2-dimethyl-3-oxobutanoate by Aladdin Scientific in 97% for only $119.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	SCHEMBL1022153 \| 342JR840KF \| Methyl 2,2-Dimethyl-3-Oxobutyrate \| Acetoacetic acid, 2,2-dimethyl-, methyl ester \| Methyl 2,2-dimethylacetoacetate \| 2,2-Dimethylacetoacetic acid methyl ester \| CHEBI:167363 \| 2,2-dimethyl-3-oxo-butyric acid methyl ester \| (
Specifications & Purity	≥97%
Storage Temp	Room temperature
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 Methyl esters Ketones Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Fatty acid ester - Beta-keto acid - Fatty acyl - Methyl ester - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - 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 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	488187031
IUPAC Name	methyl 2,2-dimethyl-3-oxobutanoate
INCHI	InChI=1S/C7H12O3/c1-5(8)7(2,3)6(9)10-4/h1-4H3
InChIKey	LVSDLZIEHYYLTC-UHFFFAOYSA-N
Smiles	CC(=O)C(C)(C)C(=O)OC
Isomeric SMILES	CC(=O)C(C)(C)C(=O)OC
Molecular Weight	144.17
Reaxy-Rn	1753940
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1753940&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.

7 results found

Lot Number	Certificate Type	Date	Item
D2315107	Certificate of Analysis	Mar 07, 2023	M193150
D2315119	Certificate of Analysis	Mar 07, 2023	M193150
D2315108	Certificate of Analysis	Mar 07, 2023	M193150
D2315109	Certificate of Analysis	Mar 07, 2023	M193150
D2315180	Certificate of Analysis	Mar 07, 2023	M193150
D2315143	Certificate of Analysis	Mar 07, 2023	M193150
D2317353	Certificate of Analysis	Mar 07, 2023	M193150

Chemical and Physical Properties

Solubility	Insoluble in water.
Molecular Weight	144.170 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	144.079 Da
Monoisotopic Mass	144.079 Da
Topological Polar Surface Area	43.400 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	158.000
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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