4-Methoxycyclohexanon supplier

Name
4-Methoxycyclohexanon
EINECS 1308068-626-2
CAS No. 13482-23-0
Article Data64
CAS DataBase
Density 0.988 g/cm³
Solubility
Melting Point
Formula C₇H₁₂O₂
Boiling Point 189.279 °C at 760 mmHg
Molecular Weight 128.171
Flash Point 68.844 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms p-Methoxycyclohexanone;
PSA 26.30000
LogP 1.14450

Synthetic route

: 56292-99-0
4-methoxycyclohexanone ethylene ketal

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
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

Conditions	Yield
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

Conditions	Yield
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 ether	67%

: 13482-22-9
4-hydroxycyclohexanone

: 74-88-4
methyl iodide

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
(i) NaH, benzene, (ii) /BRN= 969135/; Multistep reaction;

1-methoxy-cyclohexanol-(4): 1-methoxy-cyclohexanol-(4)

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
With chromium(VI) oxide; acetic acid

cyclohexanediol-(1.4)-monomethyl ether: cyclohexanediol-(1.4)-monomethyl ether

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
With chromium(III) oxide; sulfuric acid

: 22428-87-1
4,4-ethylenedioxycyclohexan-1-ol

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
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

Conditions	Yield
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

Conditions	Yield
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

Conditions	Yield
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

: 22428-87-1
4,4-ethylenedioxycyclohexan-1-ol

A: 13482-23-0
4-methoxycyclohexanone

B <(Ξ)-5α-cholestan-3-yliden>-acetaldehyde: <(Ξ)-5α-cholestan-3-yliden>-acetaldehyde

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 81 percent / KOH / dimethylsulfoxide / Ambient temperature 2: 85 percent / oxalic acid / CH2Cl2; H2O / Ambient temperature View Scheme

: 4746-97-8
cyclohexanedione monoethylene ketal

A: 13482-23-0
4-methoxycyclohexanone

B <(Ξ)-5α-cholestan-3-yliden>-acetaldehyde: <(Ξ)-5α-cholestan-3-yliden>-acetaldehyde

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: 98 percent / NaBH4 / methanol / 1.) 0 deg C, 0.5 h, 2.) room temperature, 1 h 2: 81 percent / KOH / dimethylsulfoxide / Ambient temperature 3: 85 percent / oxalic acid / CH2Cl2; H2O / Ambient temperature View Scheme

: 637-88-7
1,4-Cyclohexanedione

allylaluminium bromide: allylaluminium bromide

A: 13482-23-0
4-methoxycyclohexanone

B <(Ξ)-5α-cholestan-3-yliden>-acetaldehyde: <(Ξ)-5α-cholestan-3-yliden>-acetaldehyde

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: 4.84 g / conc. H2SO4 / benzene / Heating 2: 98 percent / NaBH4 / methanol / 1.) 0 deg C, 0.5 h, 2.) room temperature, 1 h 3: 81 percent / KOH / dimethylsulfoxide / Ambient temperature 4: 85 percent / oxalic acid / CH2Cl2; H2O / Ambient temperature View Scheme

...Expand

: 22428-87-1
4,4-ethylenedioxycyclohexan-1-ol

A: 13482-23-0
4-methoxycyclohexanone

B potassium tert-pentylate: potassium tert-pentylate

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 1.) NaH / 1.) THF, 0 deg C, 2.) THF, reflux, 12 h 2: 89 percent / aq. p-TsOH / 1 h / Heating View Scheme

: 4746-97-8
cyclohexanedione monoethylene ketal

A: 13482-23-0
4-methoxycyclohexanone

B potassium tert-pentylate: potassium tert-pentylate

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: 98 percent / LiAlH4 / tetrahydrofuran / Ambient temperature 2: 1.) NaH / 1.) THF, 0 deg C, 2.) THF, reflux, 12 h 3: 89 percent / aq. p-TsOH / 1 h / Heating View Scheme

: 556-48-9
1,4-Cyclohexanediol

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 53 percent / 1) KOH / 1) water 2: 85 percent / pyridinium chlorochromate / CH2Cl2 / 3 h / Ambient temperature View Scheme
Multi-step reaction with 2 steps 1.1: potassium hydroxide / water / 1 h / Reflux 1.2: 24 h / 20 °C 2.1: pyridinium chlorochromate / dichloromethane / 4 h / Inert atmosphere View Scheme
Multi-step reaction with 2 steps 1.1: sodium hydride / mineral oil; tetrahydrofuran / 0.5 h / 0 °C 1.2: 78 h 2.1: pyridinium chlorochromate / dichloromethane / 3.5 h / 20 °C View Scheme

: 150-76-5
4-methoxy-phenol

A: 13482-23-0
4-methoxycyclohexanone

B: 18068-06-9
4-methoxycyclohexan-1-ol

Conditions

Conditions	Yield
With palladium 10% on activated carbon; sodium formate dihydrate In water at 80℃; for 0.333333h; Microwave irradiation;
With hydrogen; 5-methyl-dihydro-furan-2-one In water at 25℃; for 11h; Autoclave;

: 150-76-5
4-methoxy-phenol

A: 13482-23-0
4-methoxycyclohexanone

B: 108-94-1
cyclohexanone

Conditions

Conditions	Yield
With potassium tetrachloropalladate(II); dodecatungstophosphoric acid hydrate; hydrogen In water at 100℃; under 1500.15 Torr; for 18h;
With sodium formate In water at 80℃; for 18h; Sealed tube; chemoselective reaction;

: 100-17-4
para-methoxynitrobenzene

: 13482-23-0
4-methoxycyclohexanone

Conditions

Conditions	Yield
With carbon dioxide; palladium 10% on activated carbon; water; hydrogen at 29.84℃; under 750.075 Torr; for 6h; Catalytic behavior;

: 13482-23-0
4-methoxycyclohexanone

: 100-52-7
benzaldehyde

: C14H16O2

Conditions

Conditions	Yield
With aniline In toluene at 80℃; for 12h;	97%
With (κ2-(N,N′)-8-trifluoroacetyaminoquinolate) benzoateborane; aniline In toluene at 80℃; for 12h; Reagent/catalyst;	97%

: 13482-23-0
4-methoxycyclohexanone

: 56292-97-8
C7H13(2)HO2

Conditions

Conditions	Yield
With lithium aluminium deuteride In diethyl ether for 1h; Ambient temperature;	95%

: 75-77-4
chloro-trimethyl-silane

: 13482-23-0
4-methoxycyclohexanone

: 934550-71-7
C10H20O2Si

Conditions

Conditions	Yield
With triethylamine In N,N-dimethyl-formamide Heating;	95%

: 13482-23-0
4-methoxycyclohexanone

: 922-68-9
Methyl glyoxylate

: 379699-76-0
methyl 2-(2-oxo-5-methoxycyclohexyl)-2-hydroxyacetate

Conditions

Conditions	Yield
	95%

: 13482-23-0
4-methoxycyclohexanone

: 4301-14-8
acetylenemagnesium bromide

: 102195-49-3
1-ethynyl-4-methoxycyclohexan-1-ol

Conditions

Conditions	Yield
In tetrahydrofuran at 0 - 20℃; for 2h; Inert atmosphere;	91%

: 13482-23-0
4-methoxycyclohexanone

: 106689-40-1
4-hydrazino-5-methyl-1H-pyridin-2-one

: N-(4-methoxycyclohexylidene)-N'-(5-methyl-1H-pyrid-2-on-4-yl)hydrazine

Conditions

Conditions	Yield
In ethanol for 4h; Heating;	86%

: 13482-23-0
4-methoxycyclohexanone

: 107-21-1
ethylene glycol

: 56292-99-0
4-methoxycyclohexanone ethylene ketal

Conditions

Conditions	Yield
With magnesium sulfate; toluene-4-sulfonic acid In toluene at 110℃; for 4h;	85%

: 13482-23-0
4-methoxycyclohexanone

: 119-26-6
(2,4-dinitro-phenyl)-hydrazine

: 100610-99-9
4-methoxycyclohexanone (2,4-dinitrophenyl)hydrazone

Conditions

Conditions	Yield
With acetic acid In ethanol for 12h; Inert atmosphere; Reflux;	82%

: 13482-23-0
4-methoxycyclohexanone

: 141-05-9
Diethyl maleate

: C13H20O5

Conditions

Conditions	Yield
With iodine; zinc In tetrahydrofuran at 70℃; for 4h; Time; Inert atmosphere;	82%

: 13482-23-0
4-methoxycyclohexanone

: 106689-41-2
4-hydrazinylpyridin-2(1H)-one

: 111380-48-4
N-(4-methoxycyclohexylidene)-N'-(1H-pyrid-2-on-4-yl)hydrazine

Conditions

Conditions	Yield
In ethanol Heating;	80.5%
In ethanol for 2h; Reflux;	77%

: 13482-23-0
4-methoxycyclohexanone

: 14447-15-5
cyanoacetic acid n-propyl ester

: 2amino-6-methoxyl-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid propyl ester

Conditions

Conditions	Yield
With morpholine; sulfur In ethanol at 85℃; for 5h;	79.04%

: 37595-74-7
N,N-phenylbistrifluoromethane-sulfonimide

: 13482-23-0
4-methoxycyclohexanone

: 1092938-89-0
4-methoxycyclohex-1-en-1-yl trifluoromethanesulfonate

Conditions

Conditions	Yield
With lithium hexamethyldisilazane In tetrahydrofuran at -78 - 20℃; for 16h; Inert atmosphere;	78%
Stage #1: 4-methoxycyclohexanone With lithium diisopropyl amide In tetrahydrofuran at -78℃; for 0.166667h; Stage #2: N,N-phenylbistrifluoromethane-sulfonimide In tetrahydrofuran at -78 - 20℃;
With n-butyllithium; diisopropylamine In tetrahydrofuran; hexane at -78 - 20℃; for 1.75h; Cooling with acetone-dry ice;

: 13482-23-0
4-methoxycyclohexanone

: 616-38-6
carbonic acid dimethyl ester

: 463927-80-2
methyl 5-methoxy-2-oxo-cyclohexan-1-carboxylate

Conditions

Conditions	Yield
With sodium hydride In tetrahydrofuran Heating;	76%

: 773837-37-9
sodium cyanide

: 13482-23-0
4-methoxycyclohexanone

: 506-87-6
ammonium carbonate

: cis-8-methoxy-1,3-diazaspiro[4,5]-decane-2,4-dione

Conditions

Conditions	Yield
Stage #1: ammonium carbonate In water for 0.166667h; Stage #2: sodium cyanide In water for 0.5h; Stage #3: 4-methoxycyclohexanone In water at 50℃; for 20h;	75%

...Expand

: 13482-23-0
4-methoxycyclohexanone

: 75-16-1
methylmagnesium bromide

: 102878-81-9
4-methoxy-1-methylcyclohexan-1-ol

Conditions

Conditions	Yield
In tetrahydrofuran; diethyl ether; toluene at 0℃; for 3h;	71%

: 13482-23-0
4-methoxycyclohexanone

: 98962-99-3
DL-3-methoxy-adipic acid

Conditions

Conditions	Yield
With oxygen; tetraethylammonium perchlorate In N,N-dimethyl-formamide at 25℃; under 760 Torr; electrochemical oxidation;	67%

: 13482-23-0
4-methoxycyclohexanone

: 50606-35-4
3-(3',4',5'-trimethoxyphenyl)-3-oxopropanenitrile

: 939970-49-7
(2-amino-6-methoxy-4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone

Conditions

Conditions	Yield
With morpholine; sulfur for 21h;	64%

: 13482-23-0
4-methoxycyclohexanone

: methyl (3,3-bishydroperoxy)-5α-pregnan-17β-acetate

: methyl 3,3-(1,1-epidioxy-4-methoxycyclohexane)-5α-pregnan-17β-acetate

Conditions

Conditions	Yield
With sulfuric acid In acetonitrile at 0℃; for 24h;	63%

: 13482-23-0
4-methoxycyclohexanone

: 120-80-9
benzene-1,2-diol

Conditions

Conditions	Yield
With iodine; oxygen; dimethyl sulfoxide at 80℃; for 12h;	63%

: 13482-23-0
4-methoxycyclohexanone

: (S)-5-methoxy-2-oxepanone

Conditions

Conditions	Yield
With Escherichia coli JM109(DE3)(pET-22b) whole cells; isopropyl β-D-thiogalactopyranoside; β‐cyclodextrin; D-glucose In water at 24℃; Baeyer-Villiger oxidation;	53%

: 13482-23-0
4-methoxycyclohexanone

: 925-90-6
ethylmagnesium bromide

: 412016-80-9
1-ethyl-4-methoxycyclohexan-1-ol

Conditions

Conditions	Yield
In tetrahydrofuran; diethyl ether; toluene at 0℃; for 3h;	52%

: 13482-23-0
4-methoxycyclohexanone

: C17H19N3O2

: C24H26N2O3

Conditions

Conditions	Yield
With acetic acid for 16h; Fischer Indole Synthesis; Reflux;	45%

: 773837-37-9
sodium cyanide

: 13482-23-0
4-methoxycyclohexanone

: 506-87-6
ammonium carbonate

: cis-8-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione

Conditions

Conditions	Yield
In water at 50℃; for 15h; Bucherer-Bergs Reaction;	44.6%

...Expand

: 13482-23-0
4-methoxycyclohexanone

: 67-68-5
dimethyl sulfoxide

: 1073-29-6
2-(methylsulfenyl)phenol

Conditions

Conditions	Yield
With iodine at 80℃; for 24h; Sealed tube;	41%

: 13482-23-0
4-methoxycyclohexanone

: 4009-98-7
(methoxymethyl)triphenylphosphonium chloride

: 1-methoxy-4-(methoxymethylidene)cyclohexane

Conditions

Conditions	Yield
Stage #1: (methoxymethyl)triphenylphosphonium chloride With sodium hexamethyldisilazane In tetrahydrofuran at -10℃; for 1h; Inert atmosphere; Stage #2: 4-methoxycyclohexanone In tetrahydrofuran at -10℃; for 3h; Inert atmosphere;	40%

: 13482-23-0
4-methoxycyclohexanone

: 1205-64-7
3-Methyldiphenylamine

: 4316-54-5
N,N-diphenyl-m-toluidine

Conditions

Conditions	Yield
With palladium on activated charcoal; toluene-4-sulfonic acid In 1,3,5-trimethyl-benzene at 160℃; under 760.051 Torr; for 2h; Inert atmosphere; Schlenk technique;	35%

: 13482-23-0
4-methoxycyclohexanone

: 106-49-0
p-toluidine

: 253334-40-6
N1,N2-di-p-tolylbenzene-1,2-diamine

Conditions

Conditions	Yield
With methanesulfonic acid; iodine; dimethyl sulfoxide In N,N,N,N,N,N-hexamethylphosphoric triamide at 120℃; for 12h; Schlenk technique; Sealed tube; Green chemistry;	31%

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 .

Product Name

4-Methoxycyclohexanon

Synthetic route

4-Methoxycyclohexanon Chemical Properties

4-Methoxycyclohexanon Specification

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