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(S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one
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Name

(S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one

 EINECS 692-970-2
CAS No. 446292-10-0 Density 1.348 g/cm3
PSA 85.10000 LogP 1.16400
Solubility N/A Melting Point 148.3-149.8 °C
Formula C14H17N3O4 Boiling Point 580.4 °C at 760 mmHg
Molecular Weight 291.307 Flash Point 304.8 °C
Transport Information N/A Appearance White solid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 446292-10-0 (3-MORPHOLINONE, 4-[4-[(5S)-5-(AMINOMETHYL)-2-OXO-3-OXAZOLIDINYL]PHENYL]-) Hazard Symbols N/A
Synonyms

(S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one;

Article Data 39

(S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one Synthetic route

1372665-04-7

4-{4-[(5S)-5-((dibenzylamino)methyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}morpholin-3-one

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
With palladium on activated charcoal; hydrogen In methanol at 40 - 50℃; under 37503.8 Torr; for 20h; Solvent; Reagent/catalyst;100%
With palladium 10% on activated carbon; hydrogen In ethyl acetate at 50℃; for 18h; Inert atmosphere;92.6%
With palladium 10% on activated carbon; hydrogen; acetic acid In methanol at 50℃; under 4200.42 Torr;2.56 g
1414932-72-1

4-{4-[(S)-5-[(((4-chlorophenyl)methylene)amino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl}-morpholin-3-one

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
With isobutylamine In toluene for 3h; Product distribution / selectivity; Reflux;99.7%
With isobutylamine In toluene for 3h; Concentration; Solvent; Time; Temperature; Reagent/catalyst; Heating; Reflux;99.7%
With hydrogenchloride; triethylamine In ethanol; water at 22 - 65℃; for 1h;95%
With hydrogenchloride In water for 0.333333h; Time;
898543-06-1

4-{4-[(5S)-5-(amino methyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}morpholin-3-one hydrochloride

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
In dichloromethane; water pH=8; Concentration;96.7%
With potassium carbonate In methanol at 25 - 30℃; for 0.5h;56%
With potassium carbonate In methanol at 25 - 30℃; for 0.5h;56%
With potassium carbonate In water at 20℃; for 2h;
446292-08-6

2-({(5S)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-1,3-oxazolidin-5-yl}methyl)-1H-isoindole-1,3(2H)-dione

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
With hydrazine hydrate In methanol at 80℃; for 2.5h;96.1%
With ethanolamine In toluene at 75 - 85℃; for 2h; Solvent; Temperature;95.87%
With hydrazine hydrate In ethanol for 2h; Reflux;95.4%
1349248-79-8

4-{4-[(5R)-5-(azidomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}-morpholin-3-one

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
With 5%-palladium/activated carbon; hydrogen In ethanol at 40℃; for 24h;96%
With 5%-palladium/activated carbon; hydrogen In ethyl acetate for 12h;91%
With palladium 10% on activated carbon; hydrogen In methanol under 1500.15 - 3000.3 Torr; for 4h;90.9%
With 5%-palladium/activated carbon; hydrogen In ethyl acetate at 45℃; under 3750.38 - 6000.6 Torr; for 8h; Autoclave;80%
With water; triphenylphosphine In tetrahydrofuran at 10 - 65℃;18 g
446292-07-5

2-((2R)-2-hydroxy-3-{[4-(3-oxo-4-morpholinyl)phenyl]amino}propyl)-1H-isoindole-1,3(2H)-dione

74-89-5

methylamine

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
Stage #1: 2-((2S)-2-hydroxy-3-{[4-(3-oxomorpholin-4-yl)phenyl]amino}propyl)-1H-isoindole-1,3(2H)-dione With dmap; 1,1'-carbonyldiimidazole In tetrahydrofuran for 12h; Reflux;
Stage #2: methylamine In ethanol; water for 8h; Reflux;		92.2%
1416129-92-4

tert-butyl {(5S)-3-[4-(3-oxo-4-morpholinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methylcarbamate

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
With hydrogenchloride; water In ethanol at 20℃; for 24h; Solvent;90%
With hydrogenchloride In ethanol; water at 20℃; for 24h; Solvent;90%
1414932-73-2

(S)-4-(4-{5-[(benzylidene-amino)-methyl]-2-oxo-oxazolidine-3-yl}-phenyl)-morpholin-3-one

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
With hydrogenchloride; water In ethanol at 20℃; for 24h; Solvent;90%
With hydrogenchloride In ethanol; water at 20℃; for 24h; Solvent; Time;90%

C14H14N2O5

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
Stage #1: C14H14N2O5 With ammonium hydroxide In methanol for 0.5h;
Stage #2: With methanol; sodium tetrahydroborate at 0 - 20℃; for 2.5h;		87.5%
446292-08-6

2-({(5S)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-1,3-oxazolidin-5-yl}methyl)-1H-isoindole-1,3(2H)-dione

74-89-5

methylamine

446292-10-0

4-[4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholine-3-one

Conditions
ConditionsYield
In methanol; water for 2h; Reflux;85%

(S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one Specification

The 3-Morpholinone,4-[4-[(5S)-5-(aminomethyl)-2-oxo-3-oxazolidinyl]phenyl]-, with the CAS registry number 446292-10-0, is also known as (S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one. This chemical's molecular formula is C14H17N3O4 and molecular weight is 291.30. Its systematic name is called 4-{4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}morpholin-3-one.

Physical properties of 3-Morpholinone,4-[4-[(5S)-5-(aminomethyl)-2-oxo-3-oxazolidinyl]phenyl]-: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 1; (5)#H bond acceptors: 7; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 4; (8)Index of Refraction: 1.598; (9)Molar Refractivity: 73.75 cm3; (10)Molar Volume: 216 cm3; (11)Surface Tension: 57.4 dyne/cm; (12)Density: 1.348 g/cm3; (13)Flash Point: 304.8 °C; (14)Enthalpy of Vaporization: 86.82 kJ/mol; (15)Boiling Point: 580.4 °C at 760 mmHg; (16)Vapour Pressure: 1.83E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1O[C@@H](CN)CN1c3ccc(N2C(=O)COCC2)cc3
(2)InChI: InChI=1/C14H17N3O4/c15-7-12-8-17(14(19)21-12)11-3-1-10(2-4-11)16-5-6-20-9-13(16)18/h1-4,12H,5-9,15H2/t12-/m0/s1
(3)InChIKey: DEXXSYVEWAYIGZ-LBPRGKRZBF

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