Toluene → HCID 10051121, compound

HRID 198564Notes

Reaction equation

HRID 198564 reaction equation
[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[CH:1]1([NH:7][C:8]([N:9]([CH2:10][c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[CH2:18][CH2:19][O:20][CH:21]2[CH2:22][CH:23]([CH2:27][CH2:28][CH:29]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:37][CH3:38])[CH2:24][CH2:25][CH2:26]2)=[O:39])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:54][CH2:55][Cl:56].[OH:40][C:41]([C:42]([F:43])([F:44])[F:45])=[O:46]>>[CH:1]1([NH:7][C:8]([N:9]([CH2:10][c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[CH2:18][CH2:19][O:20][CH:21]2[CH2:22][CH:23]([CH2:27][CH2:28][CH:29]([C:30](=[O:31])[OH:32])[CH2:37][CH3:38])[CH2:24][CH2:25][CH2:26]2)=[O:39])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 21082805HCID 21082805, compound

Product 1

HCID 10051121HCID 10051121, compound

Sources & evidence

ORD record
ord-3382de0cea08489aa8e3ede7a749cf8e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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