1,2-Dichloroethane → HCID 178437753, compound
Reaction equation
[CH2:1]([CH3:2])[c:3]1[n:4][c:5]([NH:20][NH2:21])[c:6]([F:19])[c:7]([N:9]2[CH2:10][C:11]3([CH2:12][CH2:13]3)[CH:14]([N:16]([CH3:17])[CH3:18])[CH2:15]2)[n:8]1.[CH2:61]([Cl:62])[CH2:63][Cl:64].[CH3:44][N:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1.[CH:22]1([CH2:27][CH:28]([C:29](=[O:30])[OH:31])[CH2:32][N:33]([O:34][CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[CH:42]=[O:43])[CH2:23][CH2:24][CH2:25][CH2:26]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH:51][n:52]1[c:53]2[n:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]([NH:20][NH:21][C:29]([CH:28]([CH2:27][CH:22]2[CH2:23][CH2:24][CH2:25][CH2:26]2)[CH2:32][N:33]([O:34][CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[CH:42]=[O:43])=[O:30])[c:6]([F:19])[c:7]([N:9]2[CH2:10][C:11]3([CH2:12][CH2:13]3)[CH:14]([N:16]([CH3:17])[CH3:18])[CH2:15]2)[n:8]1Participants
7
Sources & evidence
- ORD record
- ord-0af224d60fad40408622c7d0818886be
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
Loading…