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MilliporeSigma

271004

Acetonitrile

99.8%, anhydrous, suitable for solid phase extraction (SPE)

Acetonitrile
2 of 2 reviewers took part in a promotion

Synonym(s):

ACN, Cyanomethane, Ethyl nitrile, Methyl cyanide

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About This Item

Linear Formula:
CH3CN
CAS Number:
Molecular Weight:
41.05
NACRES:
NA.21
PubChem Substance ID:
eCl@ss:
39031501
UNSPSC Code:
12191502
EC Number:
200-835-2
MDL number:
Beilstein/REAXYS Number:
741857
Grade:
anhydrous
Assay:
99.8%
Technique(s):
solid phase extraction (SPE): suitable
Bp:
81-82 °C (lit.)
Vapor pressure:
72.8 mmHg ( 20 °C)

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Product Name

Acetonitrile, anhydrous, 99.8%

InChI key

WEVYAHXRMPXWCK-UHFFFAOYSA-N

InChI

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

SMILES string

CC#N

grade

anhydrous

vapor density

1.41 (vs air)

vapor pressure

72.8 mmHg ( 20 °C)

assay

99.8%

form

liquid

autoignition temp.

973 °F

expl. lim.

16 %

technique(s)

solid phase extraction (SPE): suitable

impurities

<0.001% water
<0.005% water (100 mL pkg)

evapn. residue

<0.0005%

color

colorless

refractive index

n20/D 1.344 (lit.)

bp

81-82 °C (lit.)

mp

−45 °C (lit.)

solubility

water: soluble (completely)

density

0.786 g/mL at 25 °C (lit.)

format

neat

Quality Level

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1 of 4

This Item
437557439134900644
Quality Level

200

Quality Level

200

Quality Level

100

Quality Level

100

grade

anhydrous

grade

ACS reagent

grade

gradient grade

grade

ZerO2®

assay

99.8%

assay

≥99.5%

assay

≥99.9%

assay

99.8%

technique(s)

solid phase extraction (SPE): suitable

technique(s)

solid phase extraction (SPE): suitable

technique(s)

HPLC: suitable, UV/Vis spectroscopy: suitable

technique(s)

-

solubility

water: soluble (completely)

solubility

water: soluble

solubility

water: soluble

solubility

-

form

liquid

form

liquid

form

liquid

form

liquid

Application

Acetonitrile may be used as a solvent to prepare:
  • 1,2-Azidoalcohols and 1,2-azidoamines via cerium(III) chloride assisted ring opening of epoxides and aziridines by sodium azide.[1]
  • Cyano-bearing indolinones by oxidative arylalkylation of olefins in the presence of palladium catalyst.[2]

It may also be used as a reactant to synthesize:
  • Bis (diphenylphosphino) acetonitrile by reacting with n-butyllithium and then with chlorodiphenylphosphine.[3]
  • β-Acetamido ketones via coupling reaction with ketones or ketoesters and aldehydes in the presence of cobalt(II) chloride.[4]

General description

Acetonitrile, an aliphatic nitrile, is widely used as an organic solvent and intermediate in organic syntheses.[5] It is transparent to UV-visible light, which makes it highly applicable in spectrophotometric and fluorimetric techniques. MeCN is utilized as a mobile phase component in many chromatographic techniques, due to its low viscosity, high elution strength and miscibility in water. It also plays a major role as an extractant medium in liquid-liquid extraction, solid-phase extraction or microextraction.[6]

pictograms

FlameExclamation mark

signalword

Danger

Hazard Classifications

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

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

35.6 °F - closed cup

flash_point_c

2.0 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


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Bis (diphenylphosphino) acetonitrile: Synthesis, ligand properties and application in catalytic carbon?carbon coupling
Braun L, et al.
Dalton Transactions, 14, 1409-1415 (2007)
Cobalt-catalysed three-component coupling involving ketones or ketoesters, aldehydes and acetonitrile: a novel one-pot synthesis of ?-acetamido ketones
Madhavaa Reddy M.
Journal of the Chemical Society. Chemical Communications, 6, 713-714 (1994)
Eagleson M.
Concise Encyclopedia Chemistry, 56-56 (1994)
Palladium-Catalyzed Oxidative Arylalkylation of Activated Alkenes: Dual C-H Bond Cleavage of an Arene and Acetonitrile.
Wu T, et al.
Angewandte Chemie (International Edition in English), 50(52), 12578-12581 (2011)
Cerium (III) chloride promoted highly regioselective ring opening of epoxides and aziridines using NaN3 in acetonitrile: a facile synthesis of 1,2-azidoalcohols and 1,2-azidoamines.
Sabitha G, et al.
Organic Letters, 4(3), 343-345 (2002)

Articles

Substances are said to be miscible in one another if they dissolve to form a uniform solution. Bookmark or download our miscibility table for common lab solvents.

Des substances sont dites miscibles si elles se dissolvent l'une dans l'autre en formant une solution uniforme. Ajoutez à vos marque-pages ou téléchargez notre tableau de miscibilité incluant les solvants de laboratoire courants.

Questions

1–5 of 5 Questions  
  1. I'm using anhydrous acetonitrile that was opened in 2017. microbubbles frequently occur in the internal tubing(Cellenone machine) . Could this be related to storing it for a long period?

    1 answer
    1. Long-term storage of anhydrous acetonitrile may contribute to the occurrence of microbubbles in the internal tubing of the Cellenone machine. Unopened bottles have a recommended retest period of three years. However, no specific long-term data is available regarding the effects of storage in tubing.

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  2. How can I determine the shelf life / expiration / retest date of this product?

    1 answer
    1. If this product has an expiration or retest date, it will be shown on the Certificate of Analysis (COA, CofA). If there is no retest or expiration date listed on the product's COA, we do not have suitable stability data to determine a shelf life. For these products, the only date on the COA will be the release date; a retest, expiration, or use-by-date will not be displayed.
      For all products, we recommend handling per defined conditions as printed in our product literature and website product descriptions. We recommend that products should be routinely inspected by customers to ensure they perform as expected.
      For products without retest or expiration dates, our standard warranty of 1 year from the date of shipment is applicable.
      For more information, please refer to the Product Dating Information document: https://www.sigmaaldrich.com/deepweb/assets/sigmaaldrich/marketing/global/documents/418/501/product-dating-information-06-25-mk.pdf

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  3. How is shipping temperature determined? And how is it related to the product storage temperature?

    1 answer
    1. Products may be shipped at a different temperature than the recommended long-term storage temperature. If the product quality is sensitive to short-term exposure to conditions other than the recommended long-term storage, it will be shipped on wet or dry-ice. If the product quality is NOT affected by short-term exposure to conditions other than the recommended long-term storage, it will be shipped at ambient temperature. As shipping routes are configured for minimum transit times, shipping at ambient temperature helps control shipping costs for our customers. For more information, please refer to the Storage and Transport Conditions document: https://www.sigmaaldrich.com/deepweb/assets/sigmaaldrich/marketing/global/documents/316/622/storage-transport-conditions-mk.pdf

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  4. Hi! By which method is the acetonitrile dried? Is molecular sieve used? Thanks!

    1 answer
    1. Unfortunately, the manufacturing process of this product is proprietary. If necessary, molecular sieves can help to further dry the product before use.

      Helpful?

  5. Hey, my name is Mohammad. We tried to develop sensor ro detect heavy metals. And I fond some peaks in the solution when I added acn 99.8% and I want to know if there is heavy metals and which metals?

    1 answer
    1. Unfortunately, this product is not tested for heavy metals. Should this be a critical issue for the specific application, see product 900667. This product is tested for trace metals and may be a better option. See the link below to review a sample Certificate of Analysis:
      https://www.sigmaaldrich.com/certificates/sapfs/PROD/sap/certificate_pdfs/COFA/Q14/900667-BULKSHBR1056.pdf

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Reviews

2 of 2 reviewers took part in a promotion
1–2 of 2 Reviews  

Active Filters

  1. Cambridge
    • Reviews 7
    • Votes 18
    5 out of 5 stars.

    Anhydrous acetonitrile

    Good quality acetonitrile. Anhydrous status has been maintained.

    Helpful?

  2. Sydney
    • Review 1
    • Votes 2
    5 out of 5 stars.

    Works well

    We have used Sigma Aldrich's anhydrous acetonitrile (271004) for the synthesis of synthetic RNA and it works well. We have recommended it to other researchers as it saves time and is safer than distilling anhydrous acetonitrile.

    Helpful?

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