1,2-Dichloroethane → HCID 75163837, compound

HRID 195925Notes

Reaction equation

HRID 195925 reaction equation
[CH2:43]([Cl:44])[CH2:45][Cl:46].[CH:57]([N:58]([CH2:59][CH3:60])[CH:61]([CH3:62])[CH3:63])([CH3:64])[CH3:65].[F:1][c:2]1[cH:3][c:4]([C:9]([CH2:10][NH:11][C:12]([CH3:13])([C:14](=[O:15])[OH:16])[CH3:17])([CH3:18])[NH:19][CH2:20][c:21]2[cH:22][n:23][c:24]3[cH:25][c:26]4[c:27]([cH:28][c:29]3[cH:30]2)[CH2:31][C:32]2([CH2:33]4)[C:34](=[O:42])[NH:35][c:36]3[n:37][cH:38][cH:39][cH:40][c:41]32)[cH:5][c:6]([F:8])[cH:7]1.[Na+:75].[O-:71][C:72]([OH:73])=[O:74].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[OH:47][n:48]1[c:49]2[c:50]([cH:51][cH:52][cH:53][cH:54]2)[n:55][n:56]1>>[F:1][c:2]1[cH:3][c:4]([C:9]2([CH3:18])[CH2:10][NH:11][C:12]([CH3:13])([CH3:17])[C:14](=[O:15])[N:19]2[CH2:20][c:21]2[cH:22][n:23][c:24]3[cH:25][c:26]4[c:27]([cH:28][c:29]3[cH:30]2)[CH2:31][C:32]2([CH2:33]4)[C:34](=[O:42])[NH:35][c:36]3[n:37][cH:38][cH:39][cH:40][c:41]32)[cH:5][c:6]([F:8])[cH:7]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 178457309HCID 178457309, compound

Product 1

HCID 75163837HCID 75163837, compound

Sources & evidence

ORD record
ord-c37d75c868e94a0cafee184c7d61813c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…