3-(3-Fluorophenyl)-3-oxopropanenitrile

Name: 3-(3-Fluorophenyl)-3-oxopropanenitrile
Brand: Vaqora Chemicals
SKU: VQ-050309

About 3-(3-Fluorophenyl)-3-oxopropanenitrile

3-(3-Fluorophenyl)-3-oxopropanenitrile is a nitrile building block carrying the CAS registry number 21667-61-8. The compound has the formula C9H6FNO, corresponding to a molecular weight of 163.15 g/mol. Alternative names: 3-Fluorobenzoylacetonitrile and 3-(3-fluoro-phenyl)-3-oxo-propionitrile.

Keep the container tightly sealed and store it in a cool, dry area. Under GHS it is labelled “Warning”, so handle it with suitable PPE and consult the SDS.

It is commonly used for organic synthesis and API synthesis. Buyers come mainly from pharmaceutical manufacturing and academic and industrial research.

Vaqora Chemicals supplies 3-(3-Fluorophenyl)-3-oxopropanenitrile in 100 mg, 250 mg, 1 g and 5 g packs, each shipped with a Certificate of Analysis (COA), and exports worldwide. SDS and detailed specification sheets can be requested with your quotation. Custom pack sizes, bulk quantities and specific analytical data can be arranged on request.

Typical applications

Organic synthesis
API synthesis

Industries

Specifications & identifiers

Chemical identifiers
Product name	3-(3-Fluorophenyl)-3-oxopropanenitrile
Catalogue No.	VQ-050309
CAS Number	21667-61-8
IUPAC name	3-(3-fluorophenyl)-3-oxopropanenitrile
Molecular formula	C₉H₆FNO
Molecular weight	163.15 g/mol
Exact mass	163.0433
HSN code	2933
InChIKey	UNGFCWRGMBVFAS-UHFFFAOYSA-N
SMILES	C1=CC(=CC(=C1)F)C(=O)CC#N
PubChem CID	2758948

Physical properties
Physical form	Other
LogP (XLogP3)	1.7
H-bond donors / acceptors	0 / 3
TPSA	40.9 Å²
Synonyms	3-Fluorobenzoylacetonitrile, 3-(3-fluoro-phenyl)-3-oxo-propionitrile, 3-Fluoro-ss-oxobenzenepropanenitrile, 3-(3-Fluorophenyl)-3-oxopropionitrile, 3-oxo-3-(3-fluorophenyl)-propanenitrile

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 3-(3-Fluorophenyl)-3-oxopropanenitrile?

The CAS Registry Number of 3-(3-Fluorophenyl)-3-oxopropanenitrile is 21667-61-8. It is also known as 3-Fluorobenzoylacetonitrile, 3-(3-fluoro-phenyl)-3-oxo-propionitrile, 3-Fluoro-ss-oxobenzenepropanenitrile.

What is the molecular formula and molecular weight of 3-(3-Fluorophenyl)-3-oxopropanenitrile?

3-(3-Fluorophenyl)-3-oxopropanenitrile has the molecular formula C9H6FNO and a molecular weight of 163.15 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-3-oxopropanenitrile.

Which grade and pack sizes of 3-(3-Fluorophenyl)-3-oxopropanenitrile can I order?

We supply 3-(3-Fluorophenyl)-3-oxopropanenitrile, in 100 mg, 250 mg, 1 g, 5 g packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with 3-(3-Fluorophenyl)-3-oxopropanenitrile?

Yes. Every lot of 3-(3-Fluorophenyl)-3-oxopropanenitrile 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 3-(3-Fluorophenyl)-3-oxopropanenitrile be shipped internationally?

Yes. 3-(3-Fluorophenyl)-3-oxopropanenitrile 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.