Conditions | Yield |
---|---|
With water at 85℃; for 12h; | 98% |
With water at 85℃; for 12h; | |
With water at 20℃; for 12h; | |
With water In water-d2 at 27℃; Kinetics; |
carbon monoxide
N-allyl-1,3-diaminopropane
A
1-(3-aminopropyl)-2-pyrrolidone
B
octahydropyrrolo[1,2-a]pyrimidine
Conditions | Yield |
---|---|
With hydrogen; dirhodium tetraacetate In benzene at 80℃; under 20685.9 Torr; for 20h; Product distribution; PPh3 and other ligands; | A 90% B 10% |
With dirhodium tetraacetate; hydrogen; triphenylphosphine In benzene at 80℃; under 20685.9 Torr; for 20h; | |
With dirhodium tetraacetate; hydrogen; tris-(o-tolyl)phosphine In benzene at 80℃; under 20685.9 Torr; for 20h; Product distribution; influence of gas composition, type of ligand; | |
With dirhodium tetraacetate; tributylphosphine; hydrogen In benzene at 80℃; under 20685.9 Torr; for 20h; |
Conditions | Yield |
---|---|
With water at 120℃; Hydrieren des Reaktionsgemisches an Raney-Kobalt bei 120grad/200at.; |
2-pyrrolidinon
3-bromopropylamine hydrochloride
1-(3-aminopropyl)-2-pyrrolidone
Conditions | Yield |
---|---|
With sodium hydride In N,N-dimethyl-formamide |
3-[(prop-2-en-1-yl)amino]propanenitrile
1-(3-aminopropyl)-2-pyrrolidone
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 70 percent / LiAlH4 2: H2, P(n-Bu)3, rhodium(II) acetate dimer / benzene / 20 h / 80 °C / 20685.9 Torr View Scheme |
2-[3-(2-Oxo-pyrrolidin-1-yl)-propyl]-isoindole-1,3-dione
1-(3-aminopropyl)-2-pyrrolidone
Conditions | Yield |
---|---|
With hydrazine hydrate |
1-(3-aminopropyl)-2-pyrrolidone
2-([(tert-butoxy)carbonyl]{2-[(4-methoxybenzyl)amino]-2-oxoethyl}amino)acetic acid
[(4-Methoxy-benzylcarbamoyl)-methyl]-{[3-(2-oxo-pyrrolidin-1-yl)-propylcarbamoyl]-methyl}-carbamic acid tert-butyl ester
Conditions | Yield |
---|---|
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 25℃; for 16h; Substitution; | 100% |
With N,N-diethyl-N-isopropylamine; benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate In N,N-dimethyl-formamide at 25℃; for 16h; | 27% |
1-(3-aminopropyl)-2-pyrrolidone
N-((tert-butyloxy)carbonyl)-N'-(2-(4-fluorophenyl)ethyl)iminodiacetic acid monoamide
N-((tert-butoxy)carbonyl)-N'-(2-(4-fluorophenyl)ethyl)-N''-(3-(N-pyrrolidin-2-onyl)propyl)iminodiacetic acid diamide
Conditions | Yield |
---|---|
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 25℃; for 16h; Substitution; | 100% |
With N,N-diethyl-N-isopropylamine; benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate In N,N-dimethyl-formamide at 25℃; for 16h; | 18% |
1-(3-aminopropyl)-2-pyrrolidone
N-((tert-butyloxy)carbonyl)-N'-(2-(4-hydroxyphenyl)ethyl)iminodiacetic acid monoamide
{[2-(4-Hydroxy-phenyl)-ethylcarbamoyl]-methyl}-{[3-(2-oxo-pyrrolidin-1-yl)-propylcarbamoyl]-methyl}-carbamic acid tert-butyl ester
Conditions | Yield |
---|---|
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 25℃; for 16h; Substitution; | 100% |
With N,N-diethyl-N-isopropylamine; benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate In N,N-dimethyl-formamide at 25℃; for 16h; | 9% |
1-(3-aminopropyl)-2-pyrrolidone
N-((tert-butyloxy)carbonyl)-N'-(4-(1',4'-dioxolano)piperidino)iminodiacetic acid monoamide
Conditions | Yield |
---|---|
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 25℃; for 16h; Substitution; | 100% |
1-(3-aminopropyl)-2-pyrrolidone
4-phenyl-1-butylamine
3-bromomethylbenzoic acid
Conditions | Yield |
---|---|
Multistep reaction.; | 100% |
Conditions | Yield |
---|---|
With tris-(dibenzylideneacetone)dipalladium(0); caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane at 85 - 95℃; Inert atmosphere; | 100% |
1-(3-aminopropyl)-2-pyrrolidone
Conditions | Yield |
---|---|
With sodium tris(acetoxy)borohydride In dichloromethane at 20℃; for 4h; Inert atmosphere; | 100% |
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 23℃; for 1h; | 98% |
carbon disulfide
1-(3-aminopropyl)-2-pyrrolidone
N-(3-isothiocyanatopropyl)-γ-butyrolactam
Conditions | Yield |
---|---|
With N-cyclohexylcarbodiimide In tetrahydrofuran at 20℃; for 5h; | 98% |
Conditions | Yield |
---|---|
In acetonitrile at 20℃; for 1h; Inert atmosphere; | 97.2% |
1-(3-aminopropyl)-2-pyrrolidone
ethyl 2-(1-ethoxyethylidene)hydrazinecarboxylate
Conditions | Yield |
---|---|
In neat (no solvent) at 160 - 180℃; for 2h; | 95.6% |
1-(3-aminopropyl)-2-pyrrolidone
Conditions | Yield |
---|---|
With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In N,N-dimethyl-formamide at 20℃; | 95% |
1-(3-aminopropyl)-2-pyrrolidone
2-formyldimedone
Conditions | Yield |
---|---|
In ethanol for 2h; Heating; | 95% |
Conditions | Yield |
---|---|
at 85℃; for 0.05h; Microwave irradiation; | 95% |
1-(3-aminopropyl)-2-pyrrolidone
iminodiacetic acid
1-[3-(2-oxo-pyrrolidin-1-yl)-propyl]-piperazine-2,6-dione
Conditions | Yield |
---|---|
at 85℃; for 0.05h; Microwave irradiation; | 94% |
3-[4-(N-methyl-N-phenylamino)pyrazolo[1,5-a]-1,3,5-triazin-8-yl]propionic acid
1-(3-aminopropyl)-2-pyrrolidone
N-[3-(2-oxopyrrolidin-1-yl)propyl]-3-[4-(N-methyl-N-phenylamino)pyrazolo[1,5-a]-1,3,5-triazin-8-yl]propionamide
Conditions | Yield |
---|---|
With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In dichloromethane at 20℃; for 24h; | 93% |
With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In dichloromethane at 20℃; | 93% |
1-(3-aminopropyl)-2-pyrrolidone
4-((2-fluorobenzyl)oxy)-3-methoxybenzaldehyde
Conditions | Yield |
---|---|
Stage #1: 1-(3-aminopropyl)-2-pyrrolidone; 4-((2-fluorobenzyl)oxy)-3-methoxybenzaldehyde With titanium(IV) isopropylate In tetrahydrofuran at 20℃; for 12h; Stage #2: With sodium tetrahydroborate In tetrahydrofuran; ethanol at 70℃; for 6h; | 91.6% |
1-(3-aminopropyl)-2-pyrrolidone
N-((tert-butyloxy)carbonyl)-N'-(5-((benzyloxycarbonyl)amino)-5-(methoxycarbonyl)pentyl)iminodiacetic acid monoamide
Conditions | Yield |
---|---|
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 25℃; for 16h; Substitution; | 91% |
1-(3-aminopropyl)-2-pyrrolidone
valinol
2-Fluoroaniline
indan-5-amine
4-methoxy-aniline
2,4,6-trimethylaniline
6-amino-3,4-benzodioxane
N-methylaniline
Conditions | Yield |
---|---|
Stage #1: 1-(3-aminopropyl)-2-pyrrolidone; valinol; C21H21ClN3O4Pol; C21H21ClN3O4Pol; C21H21ClN3O4Pol; C21H21ClN3O4Pol; C21H21ClN3O4Pol; C22H23ClN3O4Pol; C22H23ClN3O4Pol; C21H22ClN4O4Pol; C25H23ClN3O4Pol; C25H23ClN3O4Pol; C25H23ClN3O4Pol; C25H23ClN3O4Pol; C25H23ClN3O4Pol; C25H23ClN3O4Pol; C25H23ClN3O4Pol; C25H27ClN5O4Pol; C25H27ClN5O4Pol; 2-Fluoroaniline; indan-5-amine; 4-methoxy-aniline; 2,4,6-trimethylaniline; 6-amino-3,4-benzodioxane; N-methylaniline With potassium tert-butylate; tris-(dibenzylideneacetone)dipalladium(0); 1,3-bis[2,6-diisopropylphenyl]imidazolium chloride In 1,4-dioxane at 80℃; for 12h; Polystyrene; Combinatorial reaction / High throughput screening (HTS); Stage #2: With dimethylsulfide; trifluoroacetic acid In dichloromethane; water for 2h; | A 90% B 83% C 80% D 85% E 81% F 91% G 88% H 91% I 90% J 86% K 87% L 89% M 90% N 90% O 90% P 91% Q 82% R 86% S 89% T 89% U 85% V 81% W 84% X 78% |
1-(3-aminopropyl)-2-pyrrolidone
methyl 6-amino-2,3-dichloropyrazine-5-carboxylate
Conditions | Yield |
---|---|
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; Inert atmosphere; | 91% |
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide Inert atmosphere; |
Molecular Structure:
Molecular Formula: C7H14N2O
Molecular Weight: 142.1989
IUPAC Name: 1-(3-Aminopropyl)pyrrolidin-2-one
Synonyms of 1-(3-Aminopropyl)-2-pyrrolidinone (CAS NO.7663-77-6): 4-21-00-03163 (Beilstein Handbook Reference) ; BRN 0114960 ; EINECS 231-632-7 ; N-(3-Aminopropyl)-2-pyrrolidinone ; NSC 108683 ; 2-Pyrrolidinone, 1-(3-aminopropyl)- ; N-(3-Aminopropyl)pyrrolidin-2-one
CAS NO: 7663-77-6
Classification Code: Miscellaneous Reagents ; Synthetic Intermediates ; Building Blocks ; Heterocyclic Building Blocks ; Pyrrolidines
Index of Refraction: 1.503
Molar Refractivity: 39.63 cm3
Molar Volume: 134 cm3
Surface Tension: 42.3 dyne/cm
Density: 1.06 g/cm3
Flash Point: 132.4 °C
Enthalpy of Vaporization: 55.29 kJ/mol
Boiling Point: 312 °C at 760 mmHg
Vapour Pressure: 0.000545 mmHg at 25°C
1-(3-Aminopropyl)-2-pyrrolidinone (CAS NO.7663-77-6) is used as synthetic intermediate.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 320mg/kg (320mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05698, | |
mouse | LDLo | oral | 1600mg/kg (1600mg/kg) | Archives of Environmental Contamination and Toxicology. Vol. 14, Pg. 111, 1985. |
Hazard Codes of 1-(3-Aminopropyl)-2-pyrrolidinone (CAS NO.7663-77-6): C,Xi
Risk Statements: 34
R34: Causes burns.
Safety Statements: 26-27-36/37/39-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S27: Take off immediately all contaminated clothing.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: UN 3267 8/PG 2
WGK Germany: 3
RTECS: UY5739500
F: 9-34
Hazard Note: Irritant
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