Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate 6943-84-6

Name: Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate
Brand: Vaqora Chemicals
SKU: VQ-049720

About Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate

Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate (CAS 6943-84-6) is a process intermediate or related compound of Allopurinol offered by Vaqora Chemicals. Its molecular formula is C14H23NO2 and its molecular weight is 237.34 g/mol. The IUPAC name is ethyl 2-cyano-5-methyl-3-(2-methylpropyl)hex-2-enoate.

It is supplied as a solid. Reference materials should be stored sealed and away from light and moisture, as specified on the accompanying COA. Good laboratory practice and suitable PPE are recommended during handling.

It is a process intermediate or related compound in the synthesis of Allopurinol, useful for route development, impurity fate-and-purge studies and analytical method development. Our customers for this product work in pharmaceutical manufacturing and academic and industrial research.

Available in 10 mg, 25 mg, 50 mg and 100 mg packs, Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate is dispatched with a Certificate of Analysis (COA) to destinations worldwide.

Typical applications

API route development
Impurity fate & purge studies
Analytical method development

Industries

Related to Allopurinol

View every impurity, metabolite and intermediate we list for Allopurinol.

Allopurinol impurities

Specifications & identifiers

Chemical identifiers
Product name	Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate
Catalogue No.	VQ-049720
CAS Number	6943-84-6
IUPAC name	ethyl 2-cyano-5-methyl-3-(2-methylpropyl)hex-2-enoate
Molecular formula	C₁₄H₂₃NO₂
Molecular weight	237.34 g/mol
Exact mass	237.1729
InChIKey	NXFLNIMSYCMMTG-UHFFFAOYSA-N
SMILES	CCOC(=O)C(=C(CC(C)C)CC(C)C)C#N
PubChem CID	242795

Physical properties
Physical form	Solid
LogP (XLogP3)	4.3
H-bond donors / acceptors	0 / 3
TPSA	50.1 Å²

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate?

The CAS Registry Number of Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate is 6943-84-6.

What is the molecular formula and molecular weight of Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate?

Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is ethyl 2-cyano-5-methyl-3-(2-methylpropyl)hex-2-enoate.

What is Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate used for?

Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate is supplied as a characterised reference material related to Allopurinol. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate can I order?

We supply Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate?

Yes. Every lot of Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate be shipped internationally?

Yes. We export Ethyl 2-cyano-3-isobutyl-5-methylhex-2-enoate worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.