01
反応 #4058546
反応式
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関連文献 (1)
openreactiondata ↗doi:10.1039/C8SC04228D
反応条件: temp:0.00; pressure:0.00; stir:
ソース ID: ord-c2bb3b693cfa415d9715dd4dcf2324562D 化学構造データベース ID 67330612
表示可能な構造データがありません
SMILES
CC(C)(C)OC(=O)NCCCC(=O)C1=CC(=CC=C1)F——
製品情報
tert-butyl N-[4-(3-fluorophenyl)-4-oxobutyl]carbamate
tert-butyl N-[4-(3-fluorophenyl)-4-oxobutyl]carbamate (CAS 1223405-24-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS番号1223405-24-0
データベース ID67330612
分子式—
更新日2023-01-08
想定用途
想定用途
専門的研究・工業用途限定
データベース ID 67330612
計算物性
精密質量—
XLogP—
トポロジカル極性表面積—
水素結合供与体—
水素結合受容体—
回転可能結合—
- IUPAC 名
- —
- InChIKey
- —
- SMILES
- CC(C)(C)OC(=O)NCCCC(=O)C1=CC(=CC=C1)F
- InChI
- —
安全上の注意
安全性と注記
For professional research and industrial use only. Review the supplier safety data sheet before handling.
合成データ
関連反応
10 反応 · 10 文献
02
反応 #2968692
反応式
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関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US08865698B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-274f67140ff64dffb426ac3f96e73c7b03
反応 #2968691
反応式
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+表示可能な構造データがありません
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表示可能な構造データがありません
関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US08865698B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-274f67140ff64dffb426ac3f96e73c7b04
反応 #2579891
反応式
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関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09447104B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-0e0d6802bbec4410b6ba92c729e66ce805
反応 #2426959
反応式
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+表示可能な構造データがありません
関連文献 (1)
openreactiondata ↗doi:10.1039/C8SC04228D
反応条件: temp:0.00; pressure:0.00; stir:
ソース ID: ord-c2bb3b693cfa415d9715dd4dcf23245606
反応 #2367333
反応式
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関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09447104B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-0e0d6802bbec4410b6ba92c729e66ce807
反応 #2042610
反応式
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関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09127013B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-77a50d4f3c10483a9e22609fae4a53ca08
反応 #1662165
反応式
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関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US08513263B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-60fe492f43d248fbb509432194bb4e5409
反応 #498959
反応式
表示可能な構造データがありません
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関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US08865698B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-274f67140ff64dffb426ac3f96e73c7b10
反応 #121086
反応式
表示可能な構造データがありません
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表示可能な構造データがありません
関連文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09447104B2
反応条件: temp:-78.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
実験手順: In a round-bottomed flask was charged tert-butyl 2-oxopyrrolidine-1-carboxylate (2.2 g, 11.9 mmol) and THF (25 mL). The mixture was cooled down to −78° C. first, followed by slow addition of (3-fluorophenyl)magnesium bromide (17.8 mL, 17.8 mmol, 1.0 M solution in THF) over 15 minutes. The mixture was stirred for 3 hours, during which time the bath temperature rose from −78° C. to −10° C. The reaction was quenched by drop-wise addition of 1N HCl (2 mL) and warmed up to ambient temperature, followed by addition of EtOAc and water. After separating the organic layer, the aqueous layer was extracted with EtOAc three times. The combined organic layers was dried over Na2SO4 and concentrated to yield the product as a clear oil. rose from −78° C. to −10° C The reaction was quenched by drop-wise addition of 1N HCl (2 mL) warmed up to ambient temperature followed by addition of EtOAc and water After separating the organic layer the aqueous layer was extracted with EtOAc three times The combined organic layers was dried over Na2SO4 concentrated
ソース ID: ord-0e0d6802bbec4410b6ba92c729e66ce8PubChem References
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CAS 1223405-24-0tert-butyl N-[4-(3-fluorophenyl)-4-oxobutyl]carbamate
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