3-(4-Chlorobutyl)-1H-indole-5-carbonitrile

Basic Information

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CAS Number

143612-79-7

Molecular Formula

C13H13ClN2

Molecular Weight

232.71 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Powder

Melting Point

98.0 to 102.0 deg-C

Boiling Point

448.1±35.0°C at 760 mmHg

Density

1.22

SMILES

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C1=CC2=C(C=C1C#N)C(=CN2)CCCCCl

InChI

InChI=1S/C13H13ClN2/c14-6-2-1-3-11-9-16-13-5-4-10(8-15)7-12(11)13/h4-5,7,9,16H,1-3,6H2

InChIKey

NJJWMEJWFYRORL-UHFFFAOYSA-N

LogP

4.26330

Complexity

270

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

A850798
AC-25875
C3086
FT-0696598
143612-79-7
MFCD09833261
1H-Indole-5-carbonitrile, 3-(4-chlorobutyl)-
DTXSID70432273
3-(4-chloro-butyl)-5-cyanoindole
NJJWMEJWFYRORL-UHFFFAOYSA-N
L6DNG55PBH
3-(4-chlorobutyl)-1H-indol-5-carbonitrile
CL3519
3-(4-chlorobutyl)indole-5-carbonitrile
SY029478
3-(4-chlorobutyl)-1H-indole-5-carbonitrile
3-(4-chlorobutyl)-5-cyanoindole
AS-19269
SCHEMBL3082624
BCP06422
AKOS015924756
CS-M1251
UNII-L6DNG55PBH
A1-00284
AM20020489
J-510671
3-(4-Chlorobutyl)-1H-indole-5-carbonitrile
1H-Indole-5-carbonitrile,3-(4-chlorobutyl)-
3-(4-Chlorbutyl)-1H-indol-5-carbonitril
3-(4-Chlorobutyl)indole-5-carbonitrile
Vilazodone Intermediate

MDL Number

MFCD09833261

Customs Code

2933990090

FAQ

What is 3-(4-Chlorobutyl)-1H-indole-5-carbonitrile (CAS: 143612-79-7)?

3-(4-Chlorobutyl)-1H-indole-5-carbonitrile is a chemical compound with the CAS number 143612-79-7. It belongs to the class of indole derivatives and contains a nitrile group at the 5th position. The compound is known for its potential applications in organic synthesis and pharmaceutical research due to its aromatic structure and functional groups.

What are the main uses of 3-(4-Chlorobutyl)-1H-indole-5-carbonitrile (CAS: 143612-79-7)?

3-(4-Chlorobutyl)-1H-indole-5-carbonitrile is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in the synthesis of various organic compounds, including potential agrochemicals and materials for industrial use. Its unique structure makes it valuable in the creation of bioactive molecules and specialized chemical products.

Is 3-(4-Chlorobutyl)-1H-indole-5-carbonitrile (CAS: 143612-79-7) safe?

3-(4-Chlorobutyl)-1H-indole-5-carbonitrile is generally considered safe when handled properly. However, it may pose health risks if inhaled, ingested, or exposed to skin. Safety data sheets recommend using appropriate personal protective equipment (PPE) such as gloves and goggles. It should be stored in a secure, well-ventilated area to avoid accidental exposure and ensure safety standards are met.

How should 3-(4-Chlorobutyl)-1H-indole-5-carbonitrile (CAS: 143612-79-7) be stored?

3-(4-Chlorobutyl)-1H-indole-5-carbonitrile should be stored in a cool, dry, and well-ventilated place, away from direct sunlight. It is best kept in a sealed container at a temperature below 25°C and with low humidity to maintain stability. Avoid exposure to moisture and air to prevent degradation and ensure long-term preservation.