Toluene → Chloride

HRID 1559332노트

반응식

HRID 1559332 반응식
[CH2:5]1[S:6][C:7](=[S:18])[N:8]2[CH2:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[CH2:16][CH:17]12.[CH3:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[Cl:1][C:2]([Cl:3])=[O:4].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1>>[C:2]1([Cl:3])=[N+:8]2[CH2:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[CH2:16][CH:17]2[CH2:5][S:6]1.[Cl-:1]

참가 물질

6

반응물 4

HCID 1140TolueneHCID 6371PhosgeneHCID 8028TetrahydrofuranHCID 20571807(RS)-1,5,10,10a-tetrahydrothiazolo[3,4-b]isoquinoline-3-thione

생성물 2

HCID 312ChlorideHCID 203130103-Chloro-1,5,10,10a-tetrahydro-[1,3]thiazolo[3,4-b]isoquinolin-4-ium

출처 및 근거

ORD 기록
ord-be760fc1d7d942158f7742d31f5587de
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

반응 노트

불러오는 중…