Dichloromethane → HCID 178523019, compound

HRID 94653Notes

Reaction equation

HRID 94653 reaction equation
[Cl:47][CH2:48][Cl:49].[Cl:8][c:9]1[cH:10][cH:11][c:12]([N:15]2[CH2:16][CH2:17][N:18]([c:21]3[n:22][c:23]([N:31]4[CH:32]([CH2:36][NH2:37])[CH2:33][CH2:34][CH2:35]4)[c:24]4[c:25]([n:26]3)[CH2:27][CH2:28][S:29]4=[O:30])[CH2:19][CH2:20]2)[cH:13][cH:14]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[c:38]1([N:44]=[C:45]=[O:46])[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[Cl:8][c:9]1[cH:10][cH:11][c:12]([N:15]2[CH2:16][CH2:17][N:18]([c:21]3[n:22][c:23]([N:31]4[CH:32]([CH2:36][NH:37][C:45]([NH:44][c:38]5[cH:39][cH:40][cH:41][cH:42][cH:43]5)=[O:46])[CH2:33][CH2:34][CH2:35]4)[c:24]4[c:25]([n:26]3)[CH2:27][CH2:28][S:29]4=[O:30])[CH2:19][CH2:20]2)[cH:13][cH:14]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 7672Phenyl isocyanateHCID 178509971HCID 178509971, compound

Product 1

HCID 178523019HCID 178523019, compound

Sources & evidence

ORD record
ord-cf556e8923c942f79d57d42dbf7b5ce9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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