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179760

Sigma-Aldrich

2-Acetylcyclohexanone

97%

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About This Item

Fórmula linear:
CH3COC6H9(=O)
Número CAS:
874-23-7
Peso molecular:
140.18
Beilstein:
1858621
Número CE:
212-858-5
Número MDL:
MFCD00001633
Código UNSPSC:
12352100
ID de substância PubChem:
24850652
NACRES:
NA.22

Nível de qualidade

200

Ensaio

97%

Formulário

liquid

índice de refração

n20/D 1.509 (lit.)

p.e.

111-112 °C/18 mmHg (lit.)

densidade

1.078 g/mL at 25 °C (lit.)

grupo funcional

ketone

cadeia de caracteres SMILES

CC(=O)C1CCCCC1=O

InChI

1S/C8H12O2/c1-6(9)7-4-2-3-5-8(7)10/h7H,2-5H2,1H3

chave InChI

OEKATORRSPXJHE-UHFFFAOYSA-N

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Descrição geral

The keto-enol tautomerism of 2-acetylcyclohexanone (ACHE) in water was studied.

Aplicação

2-Acetylcyclohexanone was used in the synthesis of anilinoethanolamines.

Código de classe de armazenamento

10 - Combustible liquids

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

174.2 °F - closed cup

Ponto de fulgor (°C)

79 °C - closed cup

Equipamento de proteção individual

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)

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Certificados de análise (COA)

Lot/Batch Number
BCCF1541
BCCD0569
BCCC4264
BCBV6316
BCBV6315

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Sigma-Aldrich

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Sigma-Aldrich

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Emilia Iglesias
The Journal of organic chemistry, 68(7), 2680-2688 (2003-03-29)
The keto-enol tautomerism of 2-acetylcyclohexanone (ACHE) was studied in water under different experimental conditions. By contrast with other previously studied beta-diketones, the keto-enol interconversion in the ACHE system is a slow process. Under equilibrium conditions, the analysis of the absorbance
Cédric Bouteiller et al.
Organic & biomolecular chemistry, 8(5), 1111-1120 (2010-02-19)
An operationally simple and concise synthesis of anilinoethanolamines, as NMDA NR2B receptor antagonist ifenprodil analogues, was developed via a copper-catalyzed amination of the corresponding bromoarene. Coupling was achieved with linear primary alkylamines, alpha,omega-diamines, hexanolamine and benzophenone imine, as well as
Emilia Iglesias
The Journal of organic chemistry, 68(7), 2689-2697 (2003-03-29)
The kinetic study of the nitrosation of the enol of 2-acetylcyclohexanone (ACHE) has been performed in aqueous acid media in the absence and presence of alpha- and beta-cyclodextrin. The reaction is first-order with respect to both reactants concentration: [nitrite] and
Zhiyu Jia et al.
Angewandte Chemie (International ed. in English), 53(42), 11298-11301 (2014-09-10)
The α-arylation of carbonyl compounds is generally accomplished under basic conditions, both under metal catalysis and via aryl transfer from the diaryl λ(3)-iodanes. Here, we describe an alternative metal-free α-arylation using ArI(O2CCF3)2 as the source of a 2-iodoaryl group. The
Masaharu Fujita et al.
Journal of applied toxicology : JAT, 39(2), 191-208 (2018-09-18)
The amino acid derivative reactivity assay (ADRA) is an in chemico alternative to animal testing for skin sensitization that solves certain problems found in the use of the direct peptide reactivity assay (DPRA). During a recent validation study conducted at

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