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2-Methoxycyclohexanon
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About This Item
Lineare Formel:
CH3OC6H9(=O)
CAS-Nummer:
Molekulargewicht:
128.17
EG-Nummer:
MDL-Nummer:
UNSPSC-Code:
12352100
PubChem Substanz-ID:
NACRES:
NA.22
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Assay
97%
Brechungsindex
n20/D 1.455 (lit.)
bp
185 °C/750 mmHg (lit.)
Dichte
1.02 g/mL at 25 °C (lit.)
Funktionelle Gruppe
ether
ketone
SMILES String
COC1CCCCC1=O
InChI
1S/C7H12O2/c1-9-7-5-3-2-4-6(7)8/h7H,2-5H2,1H3
InChIKey
JYJURPHZXCLFDX-UHFFFAOYSA-N
Allgemeine Beschreibung
The conformational equilibrium of 2-methoxycyclohexanone was studied by infrared spectroscopy.
Anwendung
2-Methoxycyclohexanone was used in the synthesis of 2-(carbomethoxy)cyclohex-2-en-1-one.
Lagerklassenschlüssel
10 - Combustible liquids
WGK
WGK 3
Flammpunkt (°F)
156.2 °F - closed cup
Flammpunkt (°C)
69 °C - closed cup
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M P Freitas et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 59(6), 1177-1182 (2003-03-28)
The conformational equilibrium of 2-methoxycyclohexanone has been analyzed through infrared spectroscopy and theoretical calculations. These calculations indicate that six conformations may be present in the vapor phase, due to the rotation of the methoxy group around the O-C(2) bond, leading
O Hamed et al.
The Journal of organic chemistry, 66(1), 180-185 (2001-06-30)
Unsubstituted or alkyl-substituted cyclic ketones react with PdCl2 in methanol under a CO atmosphere to give mainly acyclic diesters along with some acyclic chloro-substituted monoesters. The monosubstituted cyclic ketones, 2-hydroxy- and 2-methoxycyclohexanone, do not give ring cleavage but rather produce
Qinglei Meng et al.
Nature communications, 8, 14190-14190 (2017-02-01)
Cyclohexanone and its derivatives are very important chemicals, which are currently produced mainly by oxidation of cyclohexane or alkylcyclohexane, hydrogenation of phenols, and alkylation of cyclohexanone. Here we report that bromide salt-modified Pd/C in H
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