Water → Tert-butyl 4-chloro-3-nitrobenzoate

HRID 181141

반응식

HRID 181141 반응식
[C:14]([CH3:15])([CH3:16])([CH3:17])[OH:18].[Cl:1][c:2]1[c:3]([N+:11](=[O:12])[O-:13])[cH:4][c:5]([C:6](=[O:7])[Cl:8])[cH:9][cH:10]1.[Cl:26][CH2:27][Cl:28].[OH2:25].[cH:19]1[cH:20][cH:21][n:22][cH:23][cH:24]1>>[Cl:1][c:2]1[c:3]([N+:11](=[O:12])[O-:13])[cH:4][c:5]([C:6](=[O:7])[O:18][C:14]([CH3:15])([CH3:16])[CH3:17])[cH:9][cH:10]1

참가 물질

6

반응물 5

HCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 6386tert-ButanolHCID 1234774-Chloro-3-nitrobenzoyl chloride

생성물 1

HCID 10611184Tert-butyl 4-chloro-3-nitrobenzoate

출처 및 근거

ORD 기록
ord-a65e240764534a8497cb358b2728980e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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