2-(4-Isobutylphenyl)propiononitrile

Name: 2-(4-Isobutylphenyl)propiononitrile
Brand: Zemixal
SKU: ZX-033592

Reference StandardAvailable on request

2-(4-Isobutylphenyl)propiononitrile (CAS 58609-73-7) supplier Zemixal. Request a quote with price, lead time and documents.

Pack sizes

2-(4-Isobutylphenyl)propiononitrile chemical structure

CAS number58609-73-7

FormulaC₁₃H₁₇N

Molar mass187.28 g/mol

Physical formSolid

HS code38229090

InChIKeyPKQKHWNHCKNYSW-UHFFFAOYSA-N

IUPAC name2-[4-(2-methylpropyl)phenyl]propanenitrile

About 2-(4-Isobutylphenyl)propiononitrile

2-(4-Isobutylphenyl)propiononitrile belongs to the Ibuprofen reference-standard family in the Zemixal catalogue. For your records (Reference Standard), the material is defined by CAS 58609-73-7, formula C13H17N and molar mass 187.28 g/mol. It is handled as a solid.

Use cases we see most often

Analytical method development
Method validation (AMV)
QC release testing
ANDA / DMF filings

Safe handling

Hazard communication follows GHS (Warning: H302). Our SDS lists exposure controls and first-aid measures.

Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and custom quantities are quoted on request. Every shipment includes a certificate of analysis with characterisation data. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.

Reference standards for Ibuprofen

See every impurity, metabolite and related compound we list for this API.

Ibuprofen standards

Typical uses

Analytical method development
Method validation (AMV)
QC release testing
ANDA / DMF filings

Applications

Pharmaceutical Manufacturing and QC Research Labs and Universities

Specifications and identifiers

Specifications of 2-(4-Isobutylphenyl)propiononitrile
Product name	2-(4-Isobutylphenyl)propiononitrile
Catalogue number	ZX-033592
CAS number	58609-73-7
IUPAC name	2-[4-(2-methylpropyl)phenyl]propanenitrile
Molecular formula	C₁₃H₁₇N
Molar mass	187.28 g/mol
Exact mass	187.1361
Grade	Reference Standard
Physical form	Solid
XLogP3	3.7
H-bond donors / acceptors	0 / 1
Topological polar surface area	23.8 Å²
HS code	38229090
InChIKey	PKQKHWNHCKNYSW-UHFFFAOYSA-N
SMILES	CC(C)CC1=CC=C(C=C1)C(C)C#N
PubChem CID	108374
Synonyms	2-(4-isobutylphenyl)propanenitrile, 2-(4-Isobutylphenyl)propionitrile, (+-)-2-(4'-isobutylphenyl)propionitrile, 2-(p-isobutylphenyl)propiononitrile, (+/-)-2-(4'-Isobutylphenyl)propionitrile, 2-(4-isobutylphenyl)-propionitrile, 1-cyano-1-(4-isobutylphenyl)ethane, 2-(4'-isobutylphenyl)-propionitrile, 4-Isobutyl-alpha-methylbenzeneacetonitrile, 2-[4-(2-methyl-propyl)-phenyl]-propionitrile, alpha-Methyl-4-(2-methylpropyl)benzeneacetonitrile, Benzeneacetonitrile, alpha-methyl-4-(2-methylpropyl)-

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

Irritant or harmful

Signal word Warning

H302Harmful if swallowed

Precautionary statements P264, P270, P301 + P317, P330, P501

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of 2-(4-Isobutylphenyl)propiononitrile
10 mg	Quoted on request
25 mg	Quoted on request
50 mg	Quoted on request
100 mg	Quoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about 2-(4-Isobutylphenyl)propiononitrile

Which CAS number identifies 2-(4-Isobutylphenyl)propiononitrile?

2-(4-Isobutylphenyl)propiononitrile is registered under CAS 58609-73-7. You may also see it listed as 2-(4-isobutylphenyl)propanenitrile, 2-(4-Isobutylphenyl)propionitrile, (+-)-2-(4'-isobutylphenyl)propionitrile. Our catalogue number for this item is ZX-033592.

What are the formula and molar mass of 2-(4-Isobutylphenyl)propiononitrile?

For 2-(4-Isobutylphenyl)propiononitrile, its formula is C13H17N and its molar mass is 187.28 g/mol. The systematic (IUPAC) name is 2-[4-(2-methylpropyl)phenyl]propanenitrile. InChIKey PKQKHWNHCKNYSW-UHFFFAOYSA-N lets you match it in any structure database.

How is 2-(4-Isobutylphenyl)propiononitrile used in pharmaceutical QC?

2-(4-Isobutylphenyl)propiononitrile is a characterised reference material linked to Ibuprofen. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.

What grade and pack sizes are available for 2-(4-Isobutylphenyl)propiononitrile?

This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.

Which documents come with 2-(4-Isobutylphenyl)propiononitrile?

Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.

Can Zemixal ship 2-(4-Isobutylphenyl)propiononitrile to my country?

Yes. Because 2-(4-Isobutylphenyl)propiononitrile is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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