2-Cyclohexylideneacetonitrile

Name: 2-Cyclohexylideneacetonitrile
Brand: Vaqora Chemicals
SKU: VQ-050639

About 2-Cyclohexylideneacetonitrile

2-Cyclohexylideneacetonitrile (CAS 4435-18-1) is a process intermediate or related compound of Allopurinol offered by Vaqora Chemicals. With the molecular formula C8H11N, it has a molar mass of 121.18 g/mol. Common synonyms include Acetonitrile, cyclohexylidene- and Acetonitrile, 2-cyclohexylidene-.

It is supplied as a solid. Store the standard in its sealed vial, protected from light and moisture, and follow the storage condition printed on the COA. It carries the GHS signal word “Warning” with 6 hazard statements. Review the Safety Data Sheet before use.

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.

Vaqora Chemicals supplies 2-Cyclohexylideneacetonitrile in 10 mg, 25 mg, 50 mg and 100 mg packs, each shipped with a Certificate of Analysis (COA), and exports 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	2-Cyclohexylideneacetonitrile
Catalogue No.	VQ-050639
CAS Number	4435-18-1
IUPAC name	2-cyclohexylideneacetonitrile
Molecular formula	C₈H₁₁N
Molecular weight	121.18 g/mol
Exact mass	121.0891
HSN code	2933
InChIKey	VLRQRRQHXZCEDL-UHFFFAOYSA-N
SMILES	C1CCC(=CC#N)CC1
PubChem CID	97105

Physical properties
Physical form	Solid
LogP (XLogP3)	2
H-bond donors / acceptors	0 / 1
TPSA	23.8 Å²
Synonyms	Acetonitrile, cyclohexylidene-, Acetonitrile, 2-cyclohexylidene-, delta1,alpha-Cyclohexaneacetonitrile, .delta.(1,.alpha.)-Cyclohexaneacetonitrile, Cyclohexylidene-acetonitrile, .DELTA.1,.alpha.-Cyclohexaneacetonitrile

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H302Harmful if swallowed
H312Harmful in contact with skin
H315Causes skin irritation
H319Causes serious eye irritation
H332Harmful if inhaled
H335May cause respiratory irritation

Precautionary statements: P261, P264, P264 + P265, P270, P271, P280, P301 + P317, P302 + P352, P304 + P340, P305 + P351 + P338, P317, P319, P321, P330, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

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 2-Cyclohexylideneacetonitrile?

The CAS Registry Number of 2-Cyclohexylideneacetonitrile is 4435-18-1. It is also known as Acetonitrile, cyclohexylidene-, Acetonitrile, 2-cyclohexylidene-, delta1,alpha-Cyclohexaneacetonitrile.

What is the molecular formula and molecular weight of 2-Cyclohexylideneacetonitrile?

2-Cyclohexylideneacetonitrile has the molecular formula C8H11N and a molecular weight of 121.18 g/mol. Its IUPAC name is 2-cyclohexylideneacetonitrile.

What is 2-Cyclohexylideneacetonitrile used for?

2-Cyclohexylideneacetonitrile 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 2-Cyclohexylideneacetonitrile can I order?

We supply 2-Cyclohexylideneacetonitrile, 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 2-Cyclohexylideneacetonitrile?

Yes. Every lot of 2-Cyclohexylideneacetonitrile 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 2-Cyclohexylideneacetonitrile be shipped internationally?

Yes. 2-Cyclohexylideneacetonitrile is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.