1,2-Dichloroethane → HCID 21025143, compound
Reaction equation
[C:43]([CH3:44])([CH3:45])([CH3:46])[O:47][C:48]([CH2:49][NH2:50])=[O:51].[CH2:61]([Cl:62])[CH2:63][Cl:64].[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([CH3:41])[c:7]2[n:8]([n:9][cH:10][c:11]([C:38]#[N:39])[c:12]2[NH:13][c:14]2[cH:15][cH:16][c:17]([O:20][c:21]3[c:22]([O:27][C:28]([CH3:29])([CH3:30])[C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:23][cH:24][cH:25][cH:26]3)[cH:18][cH:19]2)[cH:40]1.[CH3:81][N:82]([c:83]1[cH:84][cH:85][n:86][cH:87][cH:88]1)[CH3:89].[CH:52]([N:53]([CH2:54][CH3:55])[CH:56]([CH3:57])[CH3:58])([CH3:59])[CH3:60].[Cl:73][CH2:74][Cl:75].[Cl:77][CH2:78][CH2:79][Cl:80].[ClH:42].[ClH:65].[F:66][C:67]([F:68])([F:69])[C:70]([OH:71])=[O:72].[OH2:76]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([CH3:41])[c:7]2[n:8]([n:9][cH:10][c:11]([C:38]#[N:39])[c:12]2[NH:13][c:14]2[cH:15][cH:16][c:17]([O:20][c:21]3[c:22]([O:27][C:28]([CH3:29])([CH3:30])[C:31](=[O:32])[NH:50][CH2:49][C:48]([O:47][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:51])[cH:23][cH:24][cH:25][cH:26]3)[cH:18][cH:19]2)[cH:40]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-0bc4f9a235bd46b68e343b28e538aad9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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