1,2-Dichloroethane → HCID 69268257, compound

HRID 1210369Notes

Reaction equation

HRID 1210369 reaction equation
[Br:47][c:48]1[cH:49][cH:50][c:51]([CH2:52][NH3+:53])[c:54]([F:55])[cH:56]1.[CH2:57]([Cl:58])[CH2:59][Cl:60].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl-:46].[Cl:61][CH2:62][Cl:63].[F:8][C:9]([F:10])([F:11])[S:12]([O:13][c:14]1[c:15]([F:16])[cH:17][cH:18][cH:19][c:20]1-[c:21]1[cH:22][c:23]([F:43])[c:24]([CH2:27][NH:28][C:29](=[O:30])[C:31]2([NH:34][C:35](=[O:36])[c:37]3[cH:38][n:39][cH:40][n:41][cH:42]3)[CH2:32][CH2:33]2)[cH:25][cH:26]1)(=[O:44])=[O:45].[OH2:64]>>[c:21]1([Br:47])[cH:22][c:23]([F:43])[c:24]([CH2:27][NH:28][C:29](=[O:30])[C:31]2([NH:34][C:35](=[O:36])[c:37]3[cH:38][n:39][cH:40][n:41][cH:42]3)[CH2:32][CH2:33]2)[cH:25][cH:26]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 312ChlorideHCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 7015591HCID 7015591, compoundHCID 11307452HCID 11307452, compound

Product 1

HCID 69268257HCID 69268257, compound

Sources & evidence

ORD record
ord-fa87cd480cc14d5e9b74feae20c2bea4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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