Dichloromethane → HCID 178437512, compound

HRID 104742Notes

Reaction equation

[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:62][CH3:63])[c:10]([CH2:19][NH:20][C:21](=[O:22])[c:23]1[cH:24][c:25]([C:29](=[O:30])[NH:31][CH2:32][c:33]3[cH:34][c:35](-[c:41]4[cH:42][c:43]([CH2:47][N:48]5[CH2:49][CH:50]([CH3:61])[N:51]([C:54]([O:55][C:56]([CH3:57])([CH3:58])[CH3:59])=[O:60])[CH2:52][CH2:53]5)[cH:44][cH:45][cH:46]4)[cH:36][c:37]([O:39][CH3:40])[cH:38]3)[cH:26][cH:27][cH:28]1)[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1.[Cl:71][CH2:72][Cl:73].[F:64][C:65]([F:66])([F:67])[C:68]([OH:69])=[O:70]>>[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:62][CH3:63])[c:10]([CH2:19][NH:20][C:21](=[O:22])[c:23]1[cH:24][c:25]([C:29](=[O:30])[NH:31][CH2:32][c:33]3[cH:34][c:35](-[c:41]4[cH:42][c:43]([CH2:47][N:48]5[CH2:49][CH:50]([CH3:61])[NH:51][CH2:52][CH2:53]5)[cH:44][cH:45][cH:46]4)[cH:36][c:37]([O:39][CH3:40])[cH:38]3)[cH:26][cH:27][cH:28]1)[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1

Participants

Reactant 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 178437513HCID 178437513, compound

Product 1

HCID 178437512HCID 178437512, compound

Sources & evidence

ORD record: ord-876f991985db44a28784338384cc54d3
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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