1,1-Dichloroethane → HCID 9851229, compound
Reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:8][CH2:9][CH2:10][C:11](=[O:12])[N:13]([CH2:14][C:15]([NH:16][CH2:17][c:18]1[cH:19][c:20]([OH:30])[c:21]([C:24](=[O:25])[O:26][CH2:27][C:28]#[N:29])[cH:22][cH:23]1)=[O:31])[CH2:32][C:33](=[O:34])[NH:35][CH2:36][c:37]1[cH:38][c:39]([OH:49])[c:40]([C:41](=[O:42])[O:43][CH2:44][C:45]#[N:46])[cH:47][cH:48]1)([CH3:5])([CH3:6])[CH3:7].[Cl:57][CH:58]([Cl:59])[CH3:60].[OH:50][C:51]([C:52]([F:53])([F:54])[F:55])=[O:56]>>[NH2:8][CH2:9][CH2:10][C:11](=[O:12])[N:13]([CH2:14][C:15]([NH:16][CH2:17][c:18]1[cH:19][c:20]([OH:30])[c:21]([C:24](=[O:25])[O:26][CH2:27][C:28]#[N:29])[cH:22][cH:23]1)=[O:31])[CH2:32][C:33](=[O:34])[NH:35][CH2:36][c:37]1[cH:38][c:39]([OH:49])[c:40]([C:41](=[O:42])[O:43][CH2:44][C:45]#[N:46])[cH:47][cH:48]1Participants
4
Sources & evidence
- ORD record
- ord-d45483994cb6454482444f2c397de764
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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