4-Phenoxyphenylacetonitrile

Basic Information

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CAS Number

92163-15-0

Molecular Formula

C14H11NO

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

360-361 °C

Density

1.112 g/mL at 25 °C

Solubility

Miscible with toluene.

Refractive Index

n20/D 1.5810(lit.)

SMILES

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C1=CC=C(C=C1)OC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C14H11NO/c15-11-10-12-6-8-14(9-7-12)16-13-4-2-1-3-5-13/h1-9H,10H2

InChIKey

PCOVIPKFOQOPEH-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

241

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

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 6.1 Class 6.1

Synonyms & References

English

2-(4-Phenoxyphenyl)acetonitrile
4-Phenoxybenzyl cyanide
4-Phenoxyphenylacetonitrile
p-Phenoxyphenylacetonitrile
4-Phenoxybenzeneacetonitrile (ACI)
Acetonitrile, (p-phenoxyphenyl)- (6CI, 7CI)
(4-Phenoxyphenyl)acetonitrile
4-Phenoxybenzeneacetonitrile
SCHEMBL625835
4-Phenoxyphenylacetonitrile, 97%
DTXSID30380726
4-phenoxylphenylacetonitrile
4-phenoxy-benzeneacetonitrile
CS-0316874
AKOS015855175
4-PHENOXYBENZYL CYANIDE
2-(4-phenoxyphenyl)acetonitrile
BS-42266
92163-15-0
DTXCID10331751
MFCD00016399

MDL Number

MFCD00016399

Customs Code

2926909090

FAQ

What is 4-Phenoxyphenylacetonitrile (CAS: 92163-15-0)?

4-Phenoxyphenylacetonitrile (CAS: 92163-15-0) is a colorless to light yellow liquid. It is used as a precursor in the synthesis of various organic compounds. It has a molecular formula of C12H11NO and a molecular weight of approximately 181.23. This compound is insoluble in water but soluble in organic solvents.

What are the main uses of 4-Phenoxyphenylacetonitrile (CAS: 92163-15-0)?

4-Phenoxyphenylacetonitrile (CAS: 92163-15-0) is primarily used as an intermediate in the pharmaceutical industry for the synthesis of drugs and other organic compounds. It is also used in the preparation of dyes and other chemical products. Its use in food applications is limited due to potential toxicity concerns.

Is 4-Phenoxyphenylacetonitrile (CAS: 92163-15-0) safe?

4-Phenoxyphenylacetonitrile (CAS: 92163-15-0) is considered toxic and can cause skin irritation and respiratory issues if inhaled or contacted with skin. It should be handled with appropriate protective equipment such as gloves, goggles, and a respirator. Storage and use should be conducted in well-ventilated areas away from heat sources and flames.

How should 4-Phenoxyphenylacetonitrile (CAS: 92163-15-0) be stored?

4-Phenoxyphenylacetonitrile (CAS: 92163-15-0) should be stored in a cool, dry, and well-ventilated area away from heat and sources of ignition. The container should be tightly sealed and kept out of direct sunlight. It should be stored at room temperature (15-25°C) and away from incompatible materials such as strong acids or oxidizers.