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llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.8.0
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Dabco → 1,4-Diazabicyclo(2.2.2)octane Dihydriodide

HRID 263699
ノート
印刷プレビュー

反応式

HRID 263699 の反応式
C[Si]([I:5])(C)C.C[Si](N[Si](C)(C)C)(C)C.[CH2:15]1[N:20]2[CH2:21][CH2:22][N:17]([CH2:18][CH2:19]2)[CH2:16]1>C(#N)C>[CH2:15]1[N:20]2[CH2:21][CH2:22][N:17]([CH2:18][CH2:19]2)[CH2:16]1.[IH:5]
参加物実験手順後処理出典と根拠反応ノート

参加物

5

反応物 3

HCID 9237DabcoHCID 13838HexamethyldisilazaneHCID 85247Trimethylsilyl iodide2 回

生成物 1

HCID 867495181,4-Diazabicyclo(2.2.2)octane Dihydriodide収率 63.5%

試薬・触媒・溶媒 1

HCID 6342Acetonitrile溶媒2 回

実験手順

The 2-carboxylic acid (8c), as produced in Example 13a, was converted to the carbacephem (9a) through reaction with trimethylsilyl iodide (TMSI). Specifically, the carboxylic acid (8c) (0.726 g, 2 mM), was combined with 5 ml acetonitrile (ACN), HMDS (1.06 ml, 5 mM), and TMSI (0.72 ml, 5 mM), and the mixture was stirred for 4 hours at room temperature. DABCO (0.56 g, 5 mM) in 5 ml ACN was added and the solution stirred overnight at room temperature, yielding a DABCO-HI precipitate. Both reactions appeared normal and the DABCO reaction (elimination) gave an HPLC ratio of product to starting material of 39.1/12.0 for a conversion of about 77%. 5 ml of 1N HCl was added and the mixture stirred for 30 min. at room temperature. The pH was at 3.55. The DABCO-HI precipitate dissolved and the desired carbacephem product (9a) appeared as a precipitate. The product was filtered and washed successively with 10 ml of ACN/H2O (2/1), 5 ml of H2O, and 5 ml of ACN. Vacuum drying at 50° C. yielded 0.275 g of a nearly white solid. Yield was about 63.5%. NMR was excellent in DMSO (d-6) with trifluoroacetic acid (TFA) to dissolve. NMR (DMSO d-6, TFA): δ 1.95 (m, 2), 2.67 (m, 2), 3.94 (m, 1), 4.83 (d, 1), 8.57 (bs, 5).

後処理

  1. stirringthe solution stirred overnight at room temperature

出典と根拠

ORDレコード
ord-de77c11dffba4b6ea7a0246973b5c956
出典データセット
uspto-grants-1997_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US05644051

反応ノート

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