3-[Ethyl(3-methylphenyl)amino]propanenitrile

Basic Information

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CAS Number

148-69-6

Molecular Formula

C12H16N2

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Refractive Index

1.5470 to 1.5510

SMILES

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CCN(CCC#N)C1=CC=CC(=C1)C

InChI

InChI=1S/C12H16N2/c1-3-14(9-5-8-13)12-7-4-6-11(2)10-12/h4,6-7,10H,3,5,9H2,1-2H3

InChIKey

NPCCPMHHNIOSHL-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

204

Safety Information

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Hazard Statement

H303 May be harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

AC-11605
148-69-6
NSC93794
FT-0658300
A808805
?N-Ethyl-N-cyanoethyl-m-toluidine
UNII-C8HAT3D9UN
NSC 93794
MFCD00019859
3-(Ethyl(3-methylphenyl)amino)propanenitrile
m-Toluidine, N-cyanoethyl-N-ethyl-
W-108098
BS-44037
NSC-93794
3-(Ethyl-3-methylanilino)propanenitrile #
EINECS 205-721-6
N-.BETA.-CYANOETHYL-N-ETHYL-M-TOLUIDINE
T70312
3-(N-Ethyl-m-toluidino)propionitrite
Propanenitrile, 3-(ethyl(3-methylphenyl)amino)-
N-Ethyl-N-cyanoethyl-m-methylaniline
3-[Ethyl(3-methylphenyl)amino]propionitrile
3-(N-Ethyl-m-toluidino)propionitrile
C2877
NS00024870
n-Ethyl-n-cyanoethyl-m-toluidine
SCHEMBL6889131
DTXSID5051735
N-Ethyl-N-cyanoethyl-3-toluidine
M-METHYL-N-(2-CYANOETHYL)-N-ETHYLANILINE
N-cyanoethyl-N-ethyl-m-toluidine

MDL Number

MFCD00019859

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6)?

3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6) must comply with the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations for the European Union, and FDA/EPA requirements for chemical use in the United States. Specific guidelines include toxicity, flammability, and environmental hazards, requiring proper labeling, storage, and disposal measures.

Are there alternatives to 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6) in synthesis?

Several alternatives to 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6) exist in synthesis, including related nitriles, amines, and other functionalized compounds. Common alternatives involve using different functional groups or simpler structures, which can offer similar properties with potentially better reactivity or lower toxicity.

What is the market or research trend for 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6)?

The market for 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6) is growing in the pharmaceutical and agrochemical sectors due to its potential applications in drug synthesis and crop protection. Research trends focus on its use as a precursor in medicinal chemistry and as an environmentally friendly alternative to traditional compounds. However, ongoing studies are required to address its environmental impact and toxicity concerns.

How should waste containing 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6) be handled?

Waste containing 3-[Ethyl(3-methylphenyl)amino]propanenitrile (CAS: 148-69-6) should be collected in appropriate containers and stored in a well-ventilated area. Incineration or professional waste disposal is recommended, with adherence to local and international environmental regulations. Safety precautions include wearing appropriate personal protective equipment to prevent skin contact and inhalation, and ensuring proper documentation of waste management practices.