tert-Butyl 4-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)piperidine-1-carboxylate (HCID 17758346)

基本情報

標準SMILES: CC(C)(C)OC(=O)N1CCC(Oc2cccc(B3OC(C)(C)C(C)(C)O3)c2)CC1
InChIKey: FPMZJNWAOXERIF-UHFFFAOYSA-N
分子式: C22H34BNO5
平均分子量: 403.3 g/mol

名称と識別子

優先名称: tert-Butyl 4-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)piperidine-1-carboxylate
IUPAC: tert-butyl 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]piperidine-1-carboxylate

名称と別名

864136-41-4tert-Butyl 4-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)piperidine-1-carboxylate3-(N-BOC-Piperidin-4-yloxy)phenylboronic acid pinacol estertert-butyl 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]piperidine-1-carboxylateMFCD22683477SCHEMBL3327179FPMZJNWAOXERIF-UHFFFAOYSA-NAT23450BS-32920CS-0176680F696744A1-11877

名称をさらに表示

1-Piperidinecarboxylic acid, 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-, 1,1-dimethylethyl ester4-[3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenoxy]-piperidine-1-carboxylic acid tert-butyl estertert-Butyl4-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)piperidine-1-carboxylate

データベース識別子

PubChem CID: 17758346

物性

構造計算による物性

極性表面積: 57.2 Å²
水素結合供与体数: 0
水素結合受容体数: 5
回転可能結合数: 5
重原子数: 29
形式電荷: 0
複雑度: 564

化合物ノート

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