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7529-22-8

Basic Information
CAS No.: 7529-22-8
Name: 4-Methylmorpholine N-oxide
Article Data: 40
Molecular Structure:
Molecular Structure of 7529-22-8 (4-Methylmorpholine N-oxide)
Formula: C5H11NO2
Molecular Weight: 117.148
Synonyms: 4-Methylmorpholine4-oxide;4-Methylmorpholine oxide;N-Methylmorpholine N-oxide;N-Methylmorpholine oxide;N-methylmorpholineN-oxide;NMMO;NMO;NSC 73198;NSC 82153;4-Methylmorpholine N-oxide;
EINECS: 231-391-8
Density: 1,14 g/cm3
Melting Point: 180-184 °C
Boiling Point: 118-119 °C
Flash Point: 118-119ºC
Solubility: Soluble in water, methanol, ethanol, acetone, ethers and dimethylsulfoxide.
Appearance: Clear colorless to yellow solution
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36/37
PSA: 38.66000
LogP: -0.08020
Synthetic route
109-02-4

4-methyl-morpholine

7529-22-8

4-methylmorpholine N-oxide

Conditions
ConditionsYield
With 4-hydroperoxy-5-ethyl-3-methyllumiflavine In tert-butyl alcohol at 30℃; Rate constant;100%
With carbon dioxide; phosphoric acid; dihydrogen peroxide under 7500.75 Torr; for 0.133333h; Reagent/catalyst; Pressure; Time; Autoclave;100%
With dihydrogen peroxide; benzonitrile; Mg-Al-O-t-Bu HT (Catalyst B) In methanol; water at 65℃; for 0.5h; Product distribution / selectivity;98%
109-02-4

4-methyl-morpholine

76847-41-1

3-bromo-4,5-dihydro-5-hydroperoxy-4,4-dimethyl-3,5-diphenyl-3H-pyrazole

A

76847-42-2

3-bromo-4,5-dihydro-5-hydroxy-4,4-dimethyl-3,5-diphenyl-3H-pyrazole

B

7529-22-8

4-methylmorpholine N-oxide

Conditions
ConditionsYield
In chloroform-d1 at 34℃; Rate constant;A n/a
B 95 % Spectr.
109-02-4

4-methyl-morpholine

72229-10-8

cis-3-bromo-4,5-dihydro-5-hydroperoxy-4,4-dimethyl-3,5-diphenyl-3H-pyrazole

7529-22-8

4-methylmorpholine N-oxide

Conditions
ConditionsYield
In chloroform at 34℃; Rate constant; Mechanism; other α-azo hydroperoxides; oxidation of other amines, PhS, and olefins; var. solvents, deuterium isotope effect;
109-02-4

4-methyl-morpholine

107743-45-3

C17H16(2)HBrN2O2

7529-22-8

4-methylmorpholine N-oxide

Conditions
ConditionsYield
In chloroform at 34℃; Rate constant; Mechanism; other α-azo hydroperoxides; oxidation of other amines, Ph2S, and olefins; var. solvent, deuterium isotope effect;

4-[6-hydroxy-2,7,8-trimethyl-2-(4,8,12-trimethyl-tridecyl)-chroman-5-ylmethyl]-4-methyl-morpholin-4-ium; iodide

7529-22-8

4-methylmorpholine N-oxide

Conditions
ConditionsYield
With sodium percarbonate In hexane; dichloromethane; acetonitrile at 50℃; for 1h; Substitution; Oxidation;
201609-30-5

2a-(4-Pentenyl)-2a,3,4,5-tetrahydrobenz[cd]indole-2(1H)-one

7529-22-8

4-methylmorpholine N-oxide

201609-31-6

2a-(3-Formylpropyl)-2a,3,4,5-tetrahydrobenz[cd]indole-2(1H)-one

Conditions
ConditionsYield
With sodium periodate; osmium(VIII) oxide In 1,4-dioxane; water100%
7529-22-8

4-methylmorpholine N-oxide

180977-02-0

N-[4-nitro-2-phenylbenzoyl]-methionine methyl ester

4-Nitro-2-phenylbenzoyl-[1'(S)-ethoxycarbonyl-3'-methylsulfonyl]propyl amide

Conditions
ConditionsYield
With osmium(VIII) oxide In water; acetone; tert-butyl alcohol100%
7529-22-8

4-methylmorpholine N-oxide

77-78-1

dimethyl sulfate

N-methoxy-N-methylmorpholinium methyl sulfate

Conditions
ConditionsYield
In acetonitrile100%
64-67-5

diethyl sulfate

7529-22-8

4-methylmorpholine N-oxide

N-ethoxy-N-methylmorpholinium ethyl sulfate

Conditions
ConditionsYield
In acetonitrile for 24h;100%
2,6-anhydro-3-azido-1,4-di-O-benzyl-3,5-dideoxy-D-arabino-hex-5-enitol

2,6-anhydro-3-azido-1,4-di-O-benzyl-3,5-dideoxy-D-arabino-hex-5-enitol

7529-22-8

4-methylmorpholine N-oxide

4-azido-4-deoxy-3,6-di-O-benzyl-D-galactopyranose

Conditions
ConditionsYield
Stage #1: 2,6-anhydro-3-azido-1,4-di-O-benzyl-3,5-dideoxy-D-arabino-hex-5-enitol With osmium(VIII) oxide; water In tetrahydrofuran; tert-butyl alcohol at 20℃; for 0.5h;
Stage #2: 4-methylmorpholine N-oxide In tetrahydrofuran; tert-butyl alcohol for 28.5h;
100%
Raw Materials
109-02-4
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Specification

The 4-Methylmorpholine N-oxide, with the CAS registry number 7529-22-8, is also known as N-Methyl morpholine-N-oxide; NMO.It belongs to the product categories of Heterocycles;Aromatic Morpholines;Oxidation;Synthetic Organic Chemistry. This chemical's molecular formula is C5H11NO2 and molecular weight is 117.15. What's more,Its systematic name is 4-Methylmorpholine 4-oxide. The 4-Methylmorpholine N-oxide may cause damage to health. It is Irritating to eyes, respiratory system and skin.When you use it ,wear suitable protective clothing and gloves.In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Physical properties about 4-Methylmorpholine N-oxide are: (1)ACD/LogP: -1.636; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.74; (4)ACD/LogD (pH 7.4): -1.64; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 2.42; (8)ACD/KOC (pH 7.4): 3.06; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0.

You can still convert the following datas into molecular structure:
(1)SMILES:C[N+]1(CCOCC1)[O-];
(2)Std. InChI:InChI=1S/C5H11NO2/c1-6(7)2-4-8-5-3-6/h2-5H2,1H3;
(3)Std. InChIKey:LFTLOKWAGJYHHR-UHFFFAOYSA-N.