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4-Methoxycyclohexanon
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Name

4-Methoxycyclohexanon

 EINECS 1308068-626-2
CAS No. 13482-23-0 Density 0.988 g/cm3
PSA 26.30000 LogP 1.14450
Solubility N/A Melting Point N/A
Formula C7H12O2 Boiling Point 189.279 °C at 760 mmHg
Molecular Weight 128.171 Flash Point 68.844 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 13482-23-0 (4-Methoxycyclohexanon) Hazard Symbols N/A
Synonyms

p-Methoxycyclohexanone;

Article Data 64

4-Methoxycyclohexanon Synthetic route

56292-99-0

4-methoxycyclohexanone ethylene ketal

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
With hydrogenchloride In tetrahydrofuran; water for 0.5h; Inert atmosphere; Reflux;100%
With hydrogenchloride In tetrahydrofuran for 5h; Heating;95%
With hydrogenchloride In tetrahydrofuran; water for 0.5h; Reflux;92%
18068-06-9

4-methoxycyclohexan-1-ol

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
With phosphotungstic acid; dihydrogen peroxide In water at 90℃; for 0.966667h; Time; Temperature; Molecular sieve;99.1%
Stage #1: 4-methoxycyclohexan-1-ol With ammonium tungstate In water at 20℃; for 0.25h; Green chemistry;
Stage #2: With dihydrogen peroxide In water at 70℃; for 11h; Green chemistry;		95%
With hydrogenchloride; sodium bromate; N-(1-oxo-2,2,6,6-tetramethylpiperidin-4-yl)-benzoylamide In dichloromethane; water at 20℃; for 1.5h;94%
150-76-5

4-methoxy-phenol

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
With sodium formate; sodium hydroxide In water at 120℃; pH=12;99%
With sodium tetraborate decahydrate; palladium on activated charcoal; hydrogen at 100℃; under 3750.38 - 7500.75 Torr; Autoclave;90%
With borax; hydrogen In diethylene glycol dimethyl ether67%
13482-22-9

4-hydroxycyclohexanone

74-88-4

methyl iodide

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
(i) NaH, benzene, (ii) /BRN= 969135/; Multistep reaction;
1-methoxy-cyclohexanol-(4)

1-methoxy-cyclohexanol-(4)

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
With chromium(VI) oxide; acetic acid
cyclohexanediol-(1.4)-monomethyl ether

cyclohexanediol-(1.4)-monomethyl ether

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
With chromium(III) oxide; sulfuric acid
22428-87-1

4,4-ethylenedioxycyclohexan-1-ol

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1.1: KH / tetrahydrofuran
1.2: 5.86 g / tetrahydrofuran / 18 h / 20 °C
2.1: 95 percent / aq. HCl / tetrahydrofuran / 5 h / Heating
View Scheme
Multi-step reaction with 2 steps
1.1: potassium hydride / tetrahydrofuran / 0.52 h / -16 - 20 °C / Inert atmosphere
1.2: 48 h / 20 °C / Inert atmosphere
2.1: hydrogenchloride / tetrahydrofuran; water / 0.5 h / Inert atmosphere; Reflux
View Scheme
Multi-step reaction with 2 steps
1.1: sodium hydride / tetrahydrofuran / 0.17 h / 20 °C
1.2: 3 h
2.1: toluene-4-sulfonic acid; water / tetrahydrofuran / 100 °C
View Scheme
4746-97-8

cyclohexanedione monoethylene ketal

1-halo-2,4,5-trifluorobenzene, halo=Br or I

1-halo-2,4,5-trifluorobenzene, halo=Br or I

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: NaBH4 / methanol / 3 h / 20 °C
2.1: KH / tetrahydrofuran
2.2: 5.86 g / tetrahydrofuran / 18 h / 20 °C
3.1: 95 percent / aq. HCl / tetrahydrofuran / 5 h / Heating
View Scheme
22428-87-1

4,4-ethylenedioxycyclohexan-1-ol

allyl halide

allyl halide

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: sodium hydride
2: 0.92 g / HCl / acetone
View Scheme
4746-97-8

cyclohexanedione monoethylene ketal

13482-23-0

4-methoxycyclohexanone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 98 percent / sodium borohydride / methanol / 1 h
2: sodium hydride
3: 0.92 g / HCl / acetone
View Scheme
Multi-step reaction with 3 steps
1.1: sodium tetrahydroborate / methanol / 3 h / 0 - 20 °C / Inert atmosphere
1.2: 20 °C / Inert atmosphere
2.1: potassium hydride / tetrahydrofuran / 0.52 h / -16 - 20 °C / Inert atmosphere
2.2: 48 h / 20 °C / Inert atmosphere
3.1: hydrogenchloride / tetrahydrofuran; water / 0.5 h / Inert atmosphere; Reflux
View Scheme
Multi-step reaction with 3 steps
1.1: sodium tetrahydroborate; methanol / 2 h / 20 °C
2.1: sodium hydride / tetrahydrofuran / 0.17 h / 20 °C
2.2: 3 h
3.1: toluene-4-sulfonic acid; water / tetrahydrofuran / 100 °C
View Scheme

4-Methoxycyclohexanon Chemical Properties

Molecular Structure of 4-Methoxycyclohexanon (CAS NO.13482-23-0):

Empirical Formula: C7H12O2
Molecular Weight: 128.169
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.44
Molar Refractivity: 34.24 cm3
Molar Volume: 129.7 cm3
Surface Tension: 30.2 dyne/cm
Density: 0.98 g/cm3
Flash Point: 68.8 °C
Enthalpy of Vaporization: 42.55 kJ/mol
Boiling Point: 189.3 °C at 760 mmHg
Vapour Pressure: 0.574 mmHg at 25°C
SMILES: O=C1CCC(OC)CC1
InChI: InChI=1/C7H12O2/c1-9-7-4-2-6(8)3-5-7/h7H,2-5H2,1H3

4-Methoxycyclohexanon Specification

  4-Methoxycyclohexanon , with CAS number of 13482-23-0, can be called cyclohexanone, 4-methoxy- ; 4-Methoxy-cyclohexanone .

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