(4-Fluoro-3-methoxyphenyl)acetonitrile

Basic Information

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CAS Number

850565-37-6

Molecular Formula

C9H8FNO

Molecular Weight

165.16 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Boiling Point

278.5°C at 760 mmHg

Density

1.148

Flash Point

122.2°C

Refractive Index

1.501

SMILES

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COc1cc(CC#N)ccc1F

InChI

InChI=1S/C9H8FNO/c1-12-9-6-7(4-5-11)2-3-8(9)10/h2-3,6H,4H2,1H3

InChIKey

IWBUXMKSIMCUIX-UHFFFAOYSA-N

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2-(4-Fluoro-3-methoxyphenyl)acetonitrile
4-Fluoro-3-methoxyphenylacetonitrile
Benzeneacetonitrile,4-fluoro-3-methoxy-
3-Methoxy-4-fluorobenzyl cyanide

MDL Number

MFCD09038465

FAQ

What is (4-Fluoro-3-methoxyphenyl)acetonitrile (CAS: 850565-37-6)?

(4-Fluoro-3-methoxyphenyl)acetonitrile is a colorless to light yellow liquid with a CAS number of 850565-37-6. It has a molecular formula of C9H9FN2O and a boiling point of 128-130°C. This compound is used in pharmaceuticals and as a starting material for medicinal chemistry.

What are the main uses of (4-Fluoro-3-methoxyphenyl)acetonitrile (CAS: 850565-37-6)?

(4-Fluoro-3-methoxyphenyl)acetonitrile is primarily used in the synthesis of pharmaceuticals, particularly in the development of new drugs. It also serves as a valuable intermediate in organic chemistry reactions.

Is (4-Fluoro-3-methoxyphenyl)acetonitrile (CAS: 850565-37-6) safe?

(4-Fluoro-3-methoxyphenyl)acetonitrile is generally considered safe when handled properly. However, it should be used with caution due to its flammability. Proper protective equipment and ventilation are essential to avoid inhalation or skin contact. Always follow safety guidelines and consult the Material Safety Data Sheet (MSDS) for detailed information.

How should (4-Fluoro-3-methoxyphenyl)acetonitrile (CAS: 850565-37-6) be stored?

(4-Fluoro-3-methoxyphenyl)acetonitrile should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent evaporation and contamination. Store at room temperature (15-25°C) and avoid exposure to moisture and air. Keep out of reach of children and unauthorized personnel.