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2-Hexanone

analytical standard

Sinônimo(s):

Butyl methyl ketone

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About This Item

Fórmula linear:
CH3(CH2)3COCH3
Número CAS:
Peso molecular:
100.16
Beilstein:
1737676
Número CE:
Número MDL:
Código UNSPSC:
41116107
ID de substância PubChem:
NACRES:
NA.24

grau

analytical standard

Nível de qualidade

pressão de vapor

10 mmHg ( 39 °C)

Ensaio

≥99.5% (GC)

prazo de validade

limited shelf life, expiry date on the label

técnica(s)

HPLC: suitable
gas chromatography (GC): suitable

índice de refração

n20/D 1.401 (lit.)
n20/D 1.401

pb

127 °C (lit.)

pf

−57 °C (lit.)

densidade

0.812 g/mL at 25 °C (lit.)

aplicação(ões)

cleaning products
cosmetics
environmental
food and beverages
personal care

formato

neat

cadeia de caracteres SMILES

CCCCC(C)=O

InChI

1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3

chave InChI

QQZOPKMRPOGIEB-UHFFFAOYSA-N

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Descrição geral

2-Hexanone (MBK, 2-Oxohexane) is a volatile organic compound, that exists as a clear, colorless liquid with a sharp odor. It dissolves very easily in water, and can evaporate easily into the air as a vapor. It is occasionally found as a volatile component of normal human biofluids. It was used as an industrial hexacarbon solvent, but is no longer used or made owing to its neurotoxic nature leading to various human diseases.

Aplicação

2-Hexanone may be used as an analytical standard for the determination of the analyte in biological samples, starch-based polymers, moldy building materials, and alcoholic matrices by various chromatography techniques.

Palavra indicadora

Danger

Frases de perigo

Classificações de perigo

Flam. Liq. 3 - Repr. 2 - STOT RE 1 - STOT SE 3

Órgãos-alvo

Central nervous system

Código de classe de armazenamento

3 - Flammable liquids

Classe de risco de água (WGK)

WGK 1

Ponto de fulgor (°F)

73.4 °F - closed cup

Ponto de fulgor (°C)

23 °C - closed cup

Equipamento de proteção individual

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


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T.S.S. Dikshith
Handbook of Chemicals and Safety, 19-Apr, 228-228 (2016)
E L White et al.
Biomedical mass spectrometry, 6(4), 169-172 (1979-04-01)
A quantitative method is reported for the determination of n-hexane, 2-hexanone and 2,5-hexanedione in biological tissues by stable isotope dilution using gas chromatography mass spectrometry. n-[2H14]Hexane, 2-[2H5]hexanone and 2,5-[2H10]hexanedione are used as the isotopic diluents. After tissue homogenization and extraction
Solid-phase extraction and subsequent gas chromatography-mass spectrometry analysis for identification of complex mixtures of degradation products in starch-based polymers
Hakkarainen M, et al.
Journal of Chromatography A, 741(2), 251-263 (1996)
HPLC-DAD analysis of ketones as their 2, 4-dinitrophenylhydrazones in Brazilian sugar-cane spirits and rum
Cardoso DR, et al.
Journal of food composition and analysis, 16(5), 563-573 (2003)
Takaya Hoshikawa et al.
Chemical & pharmaceutical bulletin, 60(4), 548-553 (2012-04-03)
Intramolecular [2+2] cycloaddition of γ,δ-unsaturated ketenes derived from hex-5-enoyl chloride derivatives gave bicyclo[2.1.1]hexan-5-ones with complete regioselectivity.

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