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Acetic Acid → tert-Butyl 4-[4-(1H-tetrazol-1-yl)anilino]-1-piperidinecarboxylate

HRID 122325
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반응식

HRID 122325 반응식
[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[N:20]1[CH2:21][CH2:22][C:23](=[O:26])[CH2:24][CH2:25]1.[C:31]([O:32][BH-:33]([O:34][C:35](=[O:36])[CH3:37])[O:38][C:39](=[O:40])[CH3:41])(=[O:42])[CH3:43].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:27][C:28](=[O:29])[OH:30].[Na+:44].[Na+:45].[OH:46][C:47](=[O:48])[O-:49].[n:1]1(-[c:6]2[cH:7][cH:8][c:9]([NH2:10])[cH:11][cH:12]2)[n:2][n:3][n:4][cH:5]1>>[n:1]1(-[c:6]2[cH:7][cH:8][c:9]([NH:10][CH:23]3[CH2:22][CH2:21][N:20]([C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:19])[CH2:25][CH2:24]3)[cH:11][cH:12]2)[n:2][n:3][n:4][cH:5]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 8028TetrahydrofuranHCID 5716404-(1H-1,2,3,4-tetrazol-1-yl)anilineHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 2724942Triacetoxyborohydride

생성물

1
HCID 18539221tert-Butyl 4-[4-(1H-tetrazol-1-yl)anilino]-1-piperidinecarboxylate

출처 및 근거

ORD 기록
ord-41e36363a2a341fb803f1e557a07c390
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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