N-Boc-3-pyrrolidinone
- Product Name
- N-Boc-3-pyrrolidinone
- CAS No.
- 101385-93-7
- Chemical Name
- N-Boc-3-pyrrolidinone
- Synonyms
- TERT-BUTYL 3-OXOPYRROLIDINE-1-CARBOXYLATE;tert-butyl 2-oxopyrrolidine-1-carboxylate;1-tert-Butoxycarbonyl-3-pyrrolidone;3-OXO-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;N-Boc-3-pyrroL;BOC-3-PYRROLIDINONE;1-BOC-3-PYRROLIDONE;N-Boc-3-pyrolidinone;N-BOC-3-Pyrrolodinone;1-BOC-3-PYRROLIDINONE
- CBNumber
- CB2740029
- Molecular Formula
- C9H15NO3
- Formula Weight
- 185.22
- MOL File
- 101385-93-7.mol
N-Boc-3-pyrrolidinone Property
- Melting point:
- 34-38 °C (lit.)
- Boiling point:
- 270.9±33.0 °C(Predicted)
- Density
- 1.133±0.06 g/cm3(Predicted)
- Flash point:
- >230 °F
- storage temp.
- 2-8°C
- solubility
- Dichloromethane, Ethyl Acetate, Methanol
- pka
- -1.79±0.20(Predicted)
- form
- Low Melting Solid
- color
- White to yellow to orange
- Water Solubility
- Insoluble in water.
- InChI
- InChI=1S/C9H15NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h4-6H2,1-3H3
- InChIKey
- JSOMVCDXPUXKIC-UHFFFAOYSA-N
- SMILES
- N1(C(OC(C)(C)C)=O)CCC(=O)C1
- CAS DataBase Reference
- 101385-93-7(CAS DataBase Reference)
Safety
- Hazard Codes
- Xn,Xi
- Risk Statements
- 22-37/38-41-36/37/38-20/21/22
- Safety Statements
- 26-36/37/39-36
- WGK Germany
- 3
- Hazard Note
- Irritant
- HS Code
- 29339900
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H318Causes serious eye damage
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- 637564
- Product name
- N-Boc-3-pyrrolidinone
- Purity
- 97%
- Packaging
- 1g
- Price
- $31.24
- Updated
- 2025/07/31
- Product number
- 637564
- Product name
- N-Boc-3-pyrrolidinone
- Purity
- 97%
- Packaging
- 10g
- Price
- $278.15
- Updated
- 2025/07/31
- Product number
- B3589
- Product name
- 1-tert-Butoxycarbonyl-3-pyrrolidone
- Purity
- >95.0%(GC)
- Packaging
- 1g
- Price
- $16
- Updated
- 2025/07/31
- Product number
- B3589
- Product name
- 1-tert-Butoxycarbonyl-3-pyrrolidone
- Purity
- >95.0%(GC)
- Packaging
- 5g
- Price
- $34
- Updated
- 2025/07/31
- Product number
- B665950
- Product name
- 1-Boc-3-pyrrolidinone
- Packaging
- 10g
- Price
- $340
- Updated
- 2021/12/16
N-Boc-3-pyrrolidinone Chemical Properties,Usage,Production
Description
N-Boc-3-pyrrolidinone is an organic compound insoluble in water. It is a starting material for the synthesis of spirocyclic tetrahydrofuran and is also used in studies related to the preparation of 5-membered heterocyclic secondary alcohols with carrot as a biocatalyst[1].
Chemical Properties
Brown Oil
Uses
In the Synthesis and antibacterial evaluation of a novel series of rifabutin-like spirorifamycins 1-Boc-3-pyrrolidinone is used.
Uses
Used in a study of asymmetric hydrogen-transfer bioreduction of ketones with Leifsonia alcohol dehydrogenase.
Synthesis
83220-73-9
101385-93-7
General procedure for the synthesis of 1-tert-butoxycarbonyl-3-hydroxy-pyrrolidine from 1-tert-butoxycarbonyl-3-pyrrolidinone: To a dichloromethane (20 mL) solution of oxalyl chloride (2.8 mL, 32.4 mmol) a dichloromethane (40 mL) solution of dimethylsulfoxide (DMSO, 4.6 mL, 64.8 mmol) was slowly added at -78 °C, and subsequently the reaction mixture was stirred at -15 °C for 5 min. Next, a dichloromethane (60 mL) solution of N-Boc-3-pyrrolidinol (4.04 g, 21.6 mmol) was added at -78°C and stirring was continued for 2 hours at this temperature. Subsequently, triethylamine (15 mL, 108 mmol) was added to the reaction mixture and stirred at -78 °C for 1 hour. After that, the reaction mixture was slowly warmed to room temperature and stirring was continued for 2 hours at room temperature. After completion of the reaction, the mixture was cooled to 0 °C and the reaction was quenched with saturated sodium bicarbonate (NaHCO3) solution and diluted with ethyl acetate. The organic layer was washed sequentially with saturated sodium bicarbonate solution and saturated saline. The organic layers were combined, dried with anhydrous magnesium sulfate (MgSO4), filtered and concentrated under reduced pressure to afford the crude product 1-tert-butoxycarbonyl-3-pyrrolidinone (4 g, 100% yield), which could be used for subsequent reactions without further purification. The product was characterized by 1H NMR (400 MHz, CDCl3): δ 3.79-3.75 (m, 4H), 2.58 (t, J = 8.0 Hz, 2H), 1.47 (s, 9H).
References
[1] NAIRA VIEIRA MACHADO á. O. Enantioselective reduction of heterocyclic ketones with low level of asymmetry using carrots[J]. Biocatalysis and Biotransformation, 2021. DOI:10.1080/10242422.2021.1879795.
N-Boc-3-pyrrolidinone Preparation Products And Raw materials
Raw materials
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View Lastest Price from N-Boc-3-pyrrolidinone manufacturers
- Product
- N-Boc-3-pyrrolidinone 101385-93-7
- Price
- US $0.00/KG
- Min. Order
- 1KG
- Purity
- 98%min
- Supply Ability
- 30tons/month
- Release date
- 2023-02-22
- Product
- N-Boc-3-pyrrolidinone 101385-93-7
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 1ton
- Release date
- 2022-09-23
- Product
- N-Boc-3-pyrrolidinone 101385-93-7
- Price
- US $0.00-0.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 1 ton
- Release date
- 2024-01-02