3-(Hexylamino)propanenitrile

Basic Information

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CAS Number

55490-85-2

Molecular Formula

C9H18N2

Molecular Weight

143.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

130-134°C 12mm

Density

0,86 g/cm3

Flash Point

108.6°C

Refractive Index

1.439

SMILES

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CCCCCCNCCC#N

InChI

InChI=1S/C9H18N2/c1-2-3-4-5-8-11-9-6-7-10/h11H,2-6,8-9H2,1H3

InChIKey

IBFRLHYBIOCBTE-UHFFFAOYSA-N

LogP

2.566300000000001

Topological Polar Surface Area

12.03 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

112

Safety Information

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Hazard Class

Class IRRITANT-HARMFUL Class IRRITANT-HARMFUL

Synonyms & References

English

Propanenitrile, 3-(hexylamino)-
AKOS008963016
FT-0640314
E78522
DTXSID90339674
FS-3946
SB75776
SCHEMBL3162476
CS-0453733
3-(hexylamino)-propionitrile
3-(Hexylamino)propanenitrile #
55490-85-2
A830672
3-(Hexylamino)propionitrile
IBFRLHYBIOCBTE-UHFFFAOYSA-N
3-(Hexylamino)propanenitrile
MFCD00060315
Propanenitrile,3-(hexylamino)-
3-(hexylamino)propanenitrile

MDL Number

MFCD00060315

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 3-(Hexylamino)propanenitrile (CAS: 55490-85-2)?

3-(Hexylamino)propanenitrile (CAS: 55490-85-2) falls under the classification of hazardous chemicals. Regulatory guidelines include the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations for European manufacturers and importers, and FDA/EPA requirements for handling and storage, especially in the context of safety data sheets (SDS), environmental release prevention, and worker safety protocols.

Are there alternatives to 3-(Hexylamino)propanenitrile (CAS: 55490-85-2) in synthesis?

There are several alternatives to 3-(Hexylamino)propanenitrile (CAS: 55490-85-2) in synthesis, including other aminonitriles and alkylamines. Common substitutes include hexylamine and similar compounds, which can offer similar functional groups and properties. However, the choice of alternative depends on the specific reaction conditions and desired end product.

What is the market or research trend for 3-(Hexylamino)propanenitrile (CAS: 55490-85-2)?

The market for 3-(Hexylamino)propanenitrile (CAS: 55490-85-2) is driven by its use in specialized chemical formulations. Research trends focus on its potential in biocatalysis, surfactants, and oleochemicals. The increasing demand from these sectors suggests a growing market, with ongoing studies exploring its applications in sustainable chemistry and green chemistry initiatives.

How should waste containing 3-(Hexylamino)propanenitrile (CAS: 55490-85-2) be handled?

Waste containing 3-(Hexylamino)propanenitrile (CAS: 55490-85-2) should be collected in proper containers and stored under controlled conditions to prevent environmental contamination. For disposal, it is recommended to use professional waste disposal services that adhere to local waste management regulations. Incineration and controlled chemical treatment are common methods, ensuring that the waste is disposed of safely and in compliance with environmental protection standards.