1,1-Dichloroethane → HCID 67937056, compound
Reaction equation
[CH3:55][N:56]([CH3:57])[c:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1.[CH:25]1([N:26]=[C:27]=[N:28][CH:29]2[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]2)[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]1.[Cl:64][CH:65]([Cl:66])[CH3:67].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:10]2[C:11]([C:21](=[O:22])[O:23][CH3:24])=[C:12]([CH3:20])[NH:13][C:14]([CH3:19])=[C:15]2[C:16](=[O:17])[OH:18])[cH:7][cH:8][cH:9]1.[c:40]1([CH:50]=[CH:51][CH2:52][CH2:53][OH:54])[cH:41][cH:42][cH:43][c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]12>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:10]2[C:11]([C:21](=[O:22])[O:23][CH3:24])=[C:12]([CH3:20])[NH:13][C:14]([CH3:19])=[C:15]2[C:16](=[O:17])[O:54][CH2:53][CH2:52][CH:51]=[CH:50][c:40]2[cH:41][cH:42][cH:43][c:44]3[cH:45][cH:46][cH:47][cH:48][c:49]23)[cH:7][cH:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-5fa212370c584472a5448ed76c2d720e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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