Dichloromethane → HCID 22458252, compound

HRID 1140815Notes

Reaction equation

HRID 1140815 reaction equation
[CH2:46]([N:47]=[C:48]=[O:49])[c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[Cl:63][CH2:64][Cl:65].[F:56][C:57]([F:58])([F:59])[C:60]([OH:61])=[O:62].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][NH:9][C:10](=[O:11])[N:12]([CH2:13][CH2:14][CH3:15])[CH:16]2[CH2:17][CH2:18][N:19]([CH2:22][CH:23]3[CH2:24][N:25]([CH:34]([C:35](=[O:36])[OH:37])[CH:38]4[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]4)[CH2:26][CH:27]3[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[CH2:20][CH2:21]2)[cH:44][cH:45]1>>[cH:4]1[cH:5][cH:6][c:7]([CH2:8][NH:9][C:10](=[O:11])[N:12]([CH2:13][CH2:14][CH3:15])[CH:16]2[CH2:17][CH2:18][N:19]([CH2:22][CH:23]3[CH2:24][N:25]([CH:34]([C:35](=[O:36])[OH:37])[CH:38]4[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]4)[CH2:26][CH:27]3[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[CH2:20][CH2:21]2)[cH:44][cH:45]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 76639Benzyl isocyanateHCID 22458272HCID 22458272, compound

Product 1

HCID 22458252HCID 22458252, compound

Sources & evidence

ORD record
ord-ec4d4484ee1247a9a4c7b5847fcb2d6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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