Toluene → HCID 21315969, 화합물

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[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[Cl:16][P:17]([Cl:18])([Cl:19])([Cl:20])[Cl:21].[cH:1]1[s:2][cH:3][c:4]2[c:10]1[C:9](=[O:11])[NH:8][c:7]1[c:6]([cH:15][cH:14][cH:13][cH:12]1)[O:5]2>>[cH:1]1[s:2][cH:3][c:4]2[c:10]1[C:9]([Cl:16])=[N:8][c:7]1[c:6]([cH:15][cH:14][cH:13][cH:12]1)[O:5]2

참가 물질

반응물 3

HCID 1140Toluene

HCID 24819Phosphorus pentachloride

HCID 12581860HCID 12581860, 화합물

생성물 1

HCID 21315969HCID 21315969, 화합물

출처 및 근거

ORD 기록: ord-ead3abc670444072b135e77e73ef353c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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