Dichloromethane → HCID 178485821, compound

HRID 180117Notes

Reaction equation

HRID 180117 reaction equation
[CH3:40][N:41]=[C:42]=[O:43].[Cl:44][CH2:45][Cl:46].[Cl:8][c:9]1[cH:10][c:11](-[c:29]2[cH:30][cH:31][c:32]([O:35][C:36]([F:37])([F:38])[F:39])[cH:33][cH:34]2)[cH:12][c:13]([Cl:28])[c:14]1[CH2:15][CH:16]1[C:17](=[O:27])[N:18]([CH:21]2[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]2)[CH2:19][CH2:20]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[Cl:8][c:9]1[cH:10][c:11](-[c:29]2[cH:30][cH:31][c:32]([O:35][C:36]([F:37])([F:38])[F:39])[cH:33][cH:34]2)[cH:12][c:13]([Cl:28])[c:14]1[CH2:15][CH:16]1[C:17](=[O:27])[N:18]([CH:21]2[CH2:22][CH2:23][N:24]([C:42]([NH:41][CH3:40])=[O:43])[CH2:25][CH2:26]2)[CH2:19][CH2:20]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 12228Methyl IsocyanateHCID 68693048HCID 68693048, compound

Product 1

HCID 178485821HCID 178485821, compound

Sources & evidence

ORD record
ord-6d441ad6bff94267a395d4be51faa996
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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