3,3,3-Trifluoropropionitrile

Basic Information

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CAS Number

20530-38-5

Molecular Formula

C3H2F3N

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Specialty Chemicals UV Stabilizers

Electronic Chemicals Semiconductor Materials Etchants

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Boiling Point

Refractive Index

1.3045

SMILES

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C(C#N)C(F)(F)F

InChI

InChI=1S/H3N/h1H3

InChIKey

QGZKDVFQNNGYKY-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

94.5

Safety Information

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Hazard Statement

Synonyms & References

English

3,3,3-trifluoropropionitrile
3,3,3-trifluoropropanenitrile
2,2,2-Trifluoroethyl cyanide
trisfluoromethylacetonitrile
BBL104179
EN300-49323
SY106668
A814654
20530-38-5
SCHEMBL575696
DTXSID50507413
3,3,3-Trifluoropropionitrile
3,3,3-trifluoro-propionitrile
J-013386
AB42916
FS-4537
3,3,3-TRIFLUOROPROPIONONITRILE
Propanenitrile, 3,3,3-trifluoro-
3,3,3-tris(fluoranyl)propanenitrile
STL557993
AT19940
AKOS000151716
MFCD07784277

MDL Number

MFCD07784277

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 3,3,3-Trifluoropropionitrile (CAS: 20530-38-5)?

3,3,3-Trifluoropropionitrile (CAS: 20530-38-5) falls under the classification of a hazardous chemical as per the Globally Harmonized System of Classification and Labelling of Chemicals (GHS). It is subject to REACH regulations in the European Union, requiring registration and reporting of its use. In the United States, it is regulated by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for safety and environmental concerns.

Are there alternatives to 3,3,3-Trifluoropropionitrile (CAS: 20530-38-5) in synthesis?

3,3,3-Trifluoropropionitrile (CAS: 20530-38-5) has several analogs and isomers, including trifluoromethyl propionitrile. For alternative reagents, consider using propionitrile or similar compounds with different functional groups. These alternatives can offer similar reactivity in various chemical processes.

What is the market or research trend for 3,3,3-Trifluoropropionitrile (CAS: 20530-38-5)?

The market for 3,3,3-Trifluoropropionitrile (CAS: 20530-38-5) is expanding, driven by its use in flame retardants, pharmaceuticals, and specialty chemicals. Research is focusing on its application in developing new materials and in organic synthesis. Market trends suggest continued growth due to increasing demand in various sectors.

How should waste containing 3,3,3-Trifluoropropionitrile (CAS: 20530-38-5) be handled?

Waste containing 3,3,3-Trifluoropropionitrile (CAS: 20530-38-5) should be safely collected and stored. Proper waste disposal is crucial and often involves professional services. Incineration or chemical treatment is recommended for thorough destruction. Environmental precautions include using proper containers and personal protective equipment to prevent contamination.