ChemicalBook--->CAS DataBase List--->146256-98-6

146256-98-6

146256-98-6 Structure

146256-98-6 Structure
IdentificationBack Directory
[Name]

Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate
[CAS]

146256-98-6
[Synonyms]

1-Bo
Ethyl 1-Boc-4-Oxopyrrolid...
Ethyl 1-Boc-4-Oxopyrrolidine-3-carboxylate
Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate
EOPC Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate
Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate(EOPC)
Ethyl -N-Boc-4-Oxopyrrolidine-3-carboxylate
Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate USP/EP/BP
N1-BOC-4-Oxo-3-pyrrolidinecarboxylic acid ethyl ester
1-Boc-4-oxo-pyrrolidine-3-carboxylic acid ethyl ester
O1-tert-Butyl O3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate
Ethyl 1-tert-butoxycarbonyl-3-oxopyrrolidine-4-carboxylate
1-O-tert-butyl 3-O-ethyl 4-oxopyrrolidine-1,3-dicarboxylate
1-tert-Butyl 3-Ethyl 4-Oxopyrrolidine-1,3-dicarboxylate >
Ethyl 1-tert-butyloxycarbonyl-4-oxopyrrolidine-3-carboxylate
Ethyl 1-tert-butoxycarbonyl-3-oxopyrrolidine-4-carboxylate 97%
1-tert-Butyl 3-Ethyl 4-Oxopyrrolidine-1,3-dicarboxylate
1-Tert-Butyl 3-Ethyl 4-Oxopyrrolidine-1,3-Dicarboxylate(WX618157)
4-Oxopyrrolidine-1,3-dicarboxylic Acid 1-tert-Butyl 3-Ethyl Ester
1-tert-Butyl 3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate≥ 98%(HPLC)
1-(tert-Butoxycarbonyl)pyrrolidin-3-one-4-carboxylic acid ethyl ester
1,3-Pyrrolidinedicarboxylic acid 4-oxo-1-(1,1-dimethylethyl) 3-ethyl ester
[Molecular Formula]

C12H19NO5
[MDL Number]

MFCD06656201
[MOL File]

146256-98-6.mol
[Molecular Weight]

257.28
Chemical PropertiesBack Directory
[Melting point ]

54.0 to 59.0 °C
[Boiling point ]

120°C/0.4mmHg(lit.)
[density ]

1.182
[storage temp. ]

Inert atmosphere,Store in freezer, under -20°C
[form ]

powder to crystal
[pka]

11.19±0.20(Predicted)
[color ]

White to Light yellow
[InChI]

InChI=1S/C12H19NO5/c1-5-17-10(15)8-6-13(7-9(8)14)11(16)18-12(2,3)4/h8H,5-7H2,1-4H3
[InChIKey]

CWRFSVAKVCSOPI-UHFFFAOYSA-N
[SMILES]

N1(C(OC(C)(C)C)=O)CC(=O)C(C(OCC)=O)C1
Questions And AnswerBack Directory
[Uses]

1-tert-butyl 3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate is a useful research chemical.
Hazard InformationBack Directory
[Chemical Properties]

White to slightly yellow crystalline powd
[Synthesis]

Ethyl chloroformate

541-41-3

N-Boc-3-pyrrolidinone

101385-93-7

1-tert-Butyl 3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate

146256-98-6

1-tert-butoxycarbonyl-3-pyrrolidone (120 g) and N,N-dimethylformamide (DMF, 600 mL) were added to a 1000 mL four-neck flask and the reaction system was cooled to 0-5°C and stirred. At this temperature, sodium hydride (26 g) was added in batches, followed by the slow dropwise addition of ethyl chloroformate (70.5 g) for a controlled dropwise time of about 40 minutes. After the dropwise addition was completed, the reaction was kept at 0-5°C and continued to be stirred for 2 hours. The progress of the reaction was monitored by thin layer chromatography (TLC) and after confirming the completion of the reaction, the reaction was quenched by slowly adding ice water (3 L). The pH of the reaction solution was adjusted to 7 with dilute hydrochloric acid and subsequently extracted with ethyl acetate. The organic phases were combined, dried over anhydrous sodium sulfate and concentrated under reduced pressure to afford the intermediate 1-tert-butyl 3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate in 85% yield.

[References]

[1] Patent: CN106905325, 2017, A. Location in patent: Paragraph 0030-0032
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P271-P260-P280
[Risk Statements ]

36/38
[Safety Statements ]

36
[HazardClass ]

IRRITANT
[HS Code ]

29339900
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate(146256-98-6)1HNMR
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