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675415

Sigma-Aldrich

Acetonitrilo

≥99.9%, HPLC Plus, suitable for HPLC, poly-coated bottles

Sinônimo(s):

ACN, Cianeto de metila, Cianometano, Etil-nitrilo

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About This Item

Fórmula linear:
CH3CN
Número CAS:
Peso molecular:
41.05
Beilstein:
741857
Número CE:
Número MDL:
Código UNSPSC:
12190000
ID de substância PubChem:

product name

Acetonitrilo, HPLC Plus, ≥99.9%, poly-coated bottles

grau

HPLC Plus

Nível de qualidade

densidade de vapor

1.41 (vs air)

pressão de vapor

72.8 mmHg ( 20 °C)

Ensaio

≥99.9%

forma

liquid

temperatura de autoignição

525 °F
973 °F

Lim. expl.

16 %

técnica(s)

HPLC: suitable

Impurezas

≤0.01% water

resíduo de evaporação

≤0.0002%

cor

colorless

índice de refração

n20/D 1.344 (lit.)

pb

81-82 °C (lit.)

pf

−45 °C (lit.)

solubilidade

water: soluble

densidade

0.786 g/mL at 25 °C (lit.)

absorção

≤1 mAU at 210 nm

Absorção UV

λ: 195 nm Amax: ≤0.10
λ: 200 nm Amax: ≤0.02
λ: 228 nm Amax: ≤0.005

aplicação(ões)

food and beverages

formato

neat

cadeia de caracteres SMILES

CC#N

InChI

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

chave InChI

WEVYAHXRMPXWCK-UHFFFAOYSA-N

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Descrição geral

Acetonitrile (MeCN), an aliphatic nitrile, is a colorless liquid with a pleasant odor. It is widely used as a solvent and intermediate in organic syntheses. It is transparent to UV-visible light making it highly applicable in spectrophotometric and fluorimetric techniques. As MeCN has low viscosity, high elution strength and is highly miscible in water, it is utilized as a mobile phase component in many chromatographic techniques. Its infrared spectrum has been recorded. Synthesis of alkyl hydroperoxides in MeCN by alkane oxidation with hydrogen peroxide in the presence of iron complexes has been studied. The hydrogenation of MeCN to form ethylamine using Co–B amorphous alloy catalyst has been investigated.

Aplicação


  • Anthocyanin Separation: Acetonitrile is employed in high-performance liquid chromatography (HPLC) for the selective separation of anthocyanins. Studies have demonstrated the benefits of replacing acetonitrile with methanol in the mobile phase to control the selectivity and improve the resolution of anthocyanin separation, providing a more sustainable approach to chromatographic analysis (Deineka et al., Journal of Analytical Chemistry, 2021).

  • Detection of α-Amino Acids: Acetonitrile is used in the development of chemiluminescence methods for detecting α-amino acids. A mixed solution of water, acetonitrile, and ethyl acetate has been shown to enhance the sensitivity and accuracy of amino acid detection, making it a valuable tool for biochemical and clinical analyses (Kan et al., American Journal of Analytical Chemistry, 2020).

  • Electrochemical Detection of Biomarkers: Acetonitrile is utilized in the electrochemical detection of biomarkers such as 5-formyluracil. Labeling with (2-benzimidazolyl) acetonitrile enhances the selectivity and sensitivity of the detection, making it an important method for biomedical research and diagnostics (Tang et al., Analytical Chemistry, 2021).

  • Ligand-Assisted Excitation of Europium Complexes: Acetonitrile is used in studying the ligand-assisted excitation of Eu(III) complexes. The interaction of europium complexes with xenon difluoride in acetonitrile solution provides insights into their photophysical properties, which are essential for developing luminescent materials for various applications, including lighting and display technologies (Masyagutova et al., Journal of Fluorine Chemistry, 2024).


Pictogramas

FlameExclamation mark

Palavra indicadora

Danger

Classificações de perigo

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

Código de classe de armazenamento

3 - Flammable liquids

Classe de risco de água (WGK)

WGK 2

Ponto de fulgor (°F)

35.6 °F - closed cup

Ponto de fulgor (°C)

2.0 °C - closed cup

Equipamento de proteção individual

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


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Supelco

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Acetonitrilo

Infrared spectra of acetonitrile and acetonitrile-d3.
Pace EL and Noe LJ.
J. Chem. Phys., 49, 5317-5325 (1968)
Liquid phase hydrogenation of acetonitrile to ethylamine over the Co-B amorphous alloy catalyst.
Li H, et al.
J. Catal., 214(1), 15-25 (2003)
Hydrogen peroxide oxygenation of alkanes including methane and ethane catalyzed by iron complexes in acetonitrile.
Shul'pin GB, et al.
Advanced Synthesis & Catalysis, 346(2-3), 317-332 (2004)
Eagleson M.
Concise Encyclopedia Chemistry, 6-6 (1994)
Acetonitrile, the polarity chameleon.
Zarzycki PK, et al.
Analytical and Bioanalytical Chemistry, 397(3), 905-908 (2010)

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