(6-Fluoro-1H-indol-3-yl)acetonitrile

Basic Information

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CAS Number

2341-25-5

Molecular Formula

C10H7FN2

Molecular Weight

174.17 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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

50-53°C

Boiling Point

377.3°C at 760 mmHg

Density

1.316

Flash Point

377.3 °C at 760 mmHg

Refractive Index

1.645

SMILES

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C1=CC2=C(C=C1F)NC=C2CC#N

InChI

InChI=1S/C10H7FN2/c11-8-1-2-9-7(3-4-12)6-13-10(9)5-8/h1-2,5-6,13H,3H2

InChIKey

PLNHDPOPGAMJAW-UHFFFAOYSA-N

LogP

2.37308

Complexity

232

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

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

CS-0052255
Z410711556
AC-27779
6-fluoroindole-3-acetonitrile
(6-fluoro-1H-indol-3-yl)acetonitrile
2341-25-5
SCHEMBL1242939
AKOS009437195
DTXSID90610495
6-fluoro-1h-indol-3ylacetonitrile
1H-Indole-3-acetonitrile, 6-fluoro-
1H-6-Fluoroindole-3-acetonitrile
SB15217
MFCD09756481
PLNHDPOPGAMJAW-UHFFFAOYSA-N
BH-0439
2-(6-Fluoro-3-indolyl)acetonitrile
2-(6-fluoro-1H-indol-3-yl)acetonitrile
FT-0678198
EN300-60018
SY097422
A4912
6-Fluoroindole-3-acetonitrile
6-FLUORO-1H-INDOL-3YLACETONITRILE
(6-Fluor-indol-3-yl)-acetonitril
(6-fluoro-indol-3-yl)-acetonitrile
1H-Indole-3-acetonitrile,6-fluoro
6-Fluor-3-indolylacetonitril
(6-Fluoro-1H-indol-3-yl)-acetonitrile
3-(Cyanomethyl)-6-fluoro-1H-indole
SBB088895

MDL Number

MFCD09756481

Customs Code

2933990090

FAQ

What are the physical and chemical properties of (6-Fluoro-1H-indol-3-yl)acetonitrile (CAS: 2341-25-5)?

(6-Fluoro-1H-indol-3-yl)acetonitrile is a colorless to white crystalline solid with a molecular weight of approximately 215.14 g/mol. It has a low solubility in water but is more soluble in organic solvents like methanol and acetone. This compound is relatively stable under normal conditions but can react with strong acids and bases. It is typically used in organic synthesis and pharmaceuticals.

How is (6-Fluoro-1H-indol-3-yl)acetonitrile (CAS: 2341-25-5) typically synthesized?

(6-Fluoro-1H-indol-3-yl)acetonitrile is commonly synthesized via the reaction of 6-fluoroindole with hydrogen cyanide in the presence of a base like sodium hydroxide. This method provides high selectivity and good yield, making it a preferred route for industrial production.

What industries use (6-Fluoro-1H-indol-3-yl)acetonitrile (CAS: 2341-25-5)?

(6-Fluoro-1H-indol-3-yl)acetonitrile is primarily used in the pharmaceutical industry for developing new drug candidates. It is also used in the synthesis of certain polymers and sensors due to its structural properties. Additionally, it has applications in organic electronics, particularly in the fabrication of organic semiconductors.

What precautions should be taken when handling (6-Fluoro-1H-indol-3-yl)acetonitrile (CAS: 2341-25-5)?

When handling (6-Fluoro-1H-indol-3-yl)acetonitrile, it is important to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. This compound should be stored in a cool, dry place away from heat and ignition sources. In case of a spill, it should be cleaned up using appropriate procedures as outlined in the Material Safety Data Sheet (MSDS/SDS). Fume hoods should be used during handling to minimize inhalation risk.