(3,4-Dichlorophenyl)acetonitrile

Basic Information

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CAS Number

3218-49-3

Molecular Formula

C8H5Cl2N

Molecular Weight

186.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

39.0 to 42.0 deg-C

Boiling Point

171°C/12mmHg

Refractive Index

1.5690 (estimate)

SMILES

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C1=CC(=C(C=C1CC#N)Cl)Cl

InChI

InChI=1S/C8H5Cl2N/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3H2

InChIKey

QWZNCAFWRZZJMA-UHFFFAOYSA-N

LogP

3.05948

Complexity

172

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

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

3,4-dichlorobenzeneacetonitrile
(3,4-dichloro-phenyl)-acetonitrile
(3,4-Dichlorophenyl)acetonitrile
Benzeneacetonitrile, 3,4-dichloro-
3,4-dichlorophenylaceto-nitrile
D1794
STR03683
3,4-dichloro-phenylacetonitrile
SCHEMBL2308
W-106851
D77685
NS00029232
AC-2970
Benzeneacetonitrile, 3,4-dichloro-;4,4-Dichlorophenylacetonitrile
3,4-dichlorophenyl-acetonitrile
3218-49-3
AI3-12074
3,4-Dichlorophenylacetonitrile, 98%
DTXSID70185959
Z111875426
A25098
3,4-dichlorobenzylcyanide
InChI=1/C8H5Cl2N/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3H
EN300-21758
PS-4611
(3,4-dichlorophenyl)-acetonitrile
EINECS 221-743-9
NSC111725
AM20061095
2-(3,4-dichlorophenyl)acetonitrile
3,4-Dichlorophenylacetonitrile

MDL Number

MFCD00001909

Customs Code

29269095

FAQ

What is (3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3)?

(3,4-Dichlorophenyl)acetonitrile is a chemical compound with the CAS number 3218-49-3. It is an acetonitrile derivative containing a 3,4-dichlorophenyl group. This compound is colorless to pale yellow and is miscible with water. It is used in various industries including pharmaceuticals and research for synthesis purposes.

What are the main uses of (3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3)?

(3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3) is primarily used in the pharmaceutical and research sectors. It serves as a precursor in the synthesis of various organic compounds and drugs. Due to its unique chemical structure, it can be employed in the development of new medicinal compounds and as a reagent in laboratory settings.

Is (3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3) safe?

(3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3) can be safe under certain handling conditions. However, it is important to follow safety guidelines, including wearing appropriate protective gear such as gloves and goggles, and working in a well-ventilated area. It is toxic if ingested or inhaled and can cause skin irritation. Proper storage and disposal are essential to maintain safety.

How should (3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3) be stored?

(3,4-Dichlorophenyl)acetonitrile (CAS: 3218-49-3) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed, airtight container to prevent moisture and degradation. The storage area should be well-ventilated and accessible only to trained personnel to ensure safety and proper handling.