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Merck

360457

Sigma-Aldrich

Acetonitrile

≥99.5%, ACS reagent

Synonym(s):

ACN, Cyanomethane, Ethyl nitrile, Methyl cyanide

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About This Item

Linear Formula:
CH3CN
CAS Number:
Molecular Weight:
41.05
Beilstein:
741857
EC Number:
MDL number:
UNSPSC Code:
12191502
eCl@ss:
39031501
PubChem Substance ID:
NACRES:
NA.21
Grade:
ACS reagent
Assay:
≥99.5%
Bp:
81-82 °C (lit.)
Vapor pressure:
72.8 mmHg ( 20 °C)
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Product Name

Acetonitrile, ACS reagent, ≥99.5%

grade

ACS reagent

Quality Level

vapor density

1.41 (vs air)

vapor pressure

72.8 mmHg ( 20 °C)

Assay

≥99.5%

form

liquid

autoignition temp.

973 °F

expl. lim.

16 %

dilution

(for analytical testing)

impurities

≤0.3% water
≤0.6 μeq/g Titr. base
≤8 μeq/g Titr. acid

evapn. residue

≤0.005%

color

APHA: ≤10

refractive index

n20/D 1.344 (lit.)

bp

81-82 °C (lit.)

mp

−45 °C (lit.)

density

0.786 g/mL at 25 °C (lit.)

format

neat

SMILES string

CC#N

InChI

1S/C2H3N/c1-2-3/h1H3

InChI key

WEVYAHXRMPXWCK-UHFFFAOYSA-N

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General description

Acetonitrile (MeCN, ACN) is an aliphatic nitrile that is commonly used as a reaction solvent as well as a chemical intermediate in organic synthesis. In many chromatographic techniques, MeCN is used as a mobile phase solvent due to its low viscosity, high elution strength, and miscibility in water.

Application

Acetonitrile can be used as a solvent in:      
  • The solid-phase peptide synthesis.     
  • The sialylation reactions.      
  • The synthesis of copper nanoparticles by reduction of copper nitrate salt using NaBH4. During the preparation, ACN acts as a protecting solvent, which prevents the oxidation of nanoparticles.      
  • The preparation of diaryl selenides by Cu-catalyzed coupling reaction between aryl iodides and diphenyl diselenide. In this process, ACN also functions as a ligand for the copper catalyst to increase its catalytic activity.

Features and Benefits

ACS solvents meet or exceed the high standards of the American Chemical Society (ACS) ,with test specifications that are specialized to every compound. According to the American Chemical Society, ACS reagent grade implies that it is a substance of sufficient purity to be used in most chemical analyses or reactions.

Pictograms

FlameExclamation mark

Signal Word

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

35.6 °F - closed cup

Flash Point(C)

2.0 °C - closed cup


Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Deleterious substance

FSL

Group 4: Flammable liquids
Type 1 petroleums
Hazardous rank II
Water soluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

360457-6X500ML:4548173139340
360457-190L:
360457-1L:4548173139272
360457-10L:4548173261836
360457-18L-CS:
360457-200L-PW:
360457-6X1L:4548173139333
360457-2.5L:4548173317885
360457-20L:4548173139289
360457-BULK:
360457-4L:
360457-4X4L:4548173139319
360457-4X2L:4548173261867
360457-18L-P1-BK:
360457-VAR:
360457-200L:4548173261850
360457-25ML:4548173139296
360457-CP-50L-P2:
360457-18L:4548173261843
360457-500ML:4548173139326
360457-2L:4548173139302
360457-VAR-D:


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